Composition and Properties

In the Material Composition and Properties section on the Material form, view, edit, or establish composition and property information for materials that already exist in the database. Each material has an effective date, which is used to track and maintain changes to the information about a material. (Chemicals, mixtures, and process streams are generically labeled as materials in Essential.)

If you have established new pure materials and mixtures on the Material form, assign each one an effective date in this section. (You must assign effective dates to pure materials first in order to establish mixtures and their composition.) Then, document compositions, physical property data, vapor pressure methods and/or data, physical states, and minor component information.

The same effective date entered on the Material form is used when entering material information, such as exposure limits, on other forms. Therefore, even if you are not entering composition and property information for the material, you must at a minimum assign it an effective date before you can enter other types of material information.

Note:  The Material Composition and Properties section is also available on the Waste Profile form, so you can view, edit, or establish composition and property information for a waste stream profile.

For additional instruction on how to establish composition and property information for materials, click the following links or use the scroll bar to scan the page.

Material Composition and Properties Section Security

Adding Vapor Pressure Methods for a Material

Establishing Composition and Property Information for a Material

Entering Vapor Pressure Data for a Material

Entering the Composition of a Material

Assigning Physical States to a Material

Entering Physical Property Data for a Material

Entering Minor Components for a Material

Material Composition and Properties Section Security

Element-level security applies to the subsections in the Material Composition and Properties section on the Material form:

Assigning element user privileges can further limit user access to proprietary, important or sensitive information. For example, you may want to prohibit edits to the vapor pressure-related information while allowing updates to the physical states/properties and components information. When the privileges assigned to the Material Comp and Prop security object are more restrictive than those assigned to the subsection elements, the object's security settings override the elements'. For example, if Read permissions are assigned for the Material Composition and Properties section and Read and Update permissions for the Physical States subsection, the entire section will be Read only because the Material Composition and Properties section's (object) security is more restrictive and, thereby, overrides the Physical States subsection's (element) security.

If no permissions are granted for any subsection, no subsection will be displayed in the Material Composition and Properties section. The security assigned for the Material Comp and Properties security object only applies to the section, i.e., just the date-related and composition-related fields are displayed for users with at least Read permissions to the object but no element permissions.

Tip:  When limiting privileges for a material composition and properties, keep in mind that a separate Material Comp and Prop security object exists for every module where the Material form is available, except the Process Data Manager module. The privileges assigned in the Air module for material composition and properties also apply to the Process Data Manager module.

Refer to Setting Field-Level (Element) Security for additional information.

Establishing Composition and Property Information for a Material

To establish composition and property information for a material

  1. Locate the material on the Materials list, click the material link to open the Material form, and expand the Material Composition and Properties section if necessary.

  2. Review the Effective Date for accuracy. Click the Calendar button to change it when necessary.

    To add a new effective date, click the New Effective Date link. The new date defaults to the current date; use the calendar button to change it when applicable.

  3. Click the Do not calculate vapor Composition for emission models, use defined composition check box if you do not want the system to derive the vapor composition of the components through vapor-liquid equilibrium (VLE) calculations for air emission speciation. The system will use the vapor composition you define instead of the standard VLE calculations.

    For additional information about air emission speciation, refer to Speciating Material Releases and Speciation Method Emission Rate Determination.

  4. Add information in the Composition, Physical Properties, Vapor Pressure Methods, Vapor Pressures, Physical States, and Minor Components subsections.

  5. Click the Save button on the form.

  6. Repeat steps 2 through 5 to add material composition and properties information for a different effective date.

Entering the Composition of a Material

Note:  If you marked a material as a pure type of material, the Composition subsection will not be displayed.

For materials that are mixtures, you should specify their component materials and concentration percentages in the Composition subsection of the Material Composition and Properties section on the Material form. A process stream or mixture can be composed of one or more pure materials and mixtures. For reporting, you can mark a component material as a Trade Secret and specify a SARA material use activity. The weight percentage of a process stream must be defined for response factor calculations.

To enter the composition of a material

  1. Locate the material on the Materials list, click the material link to open the Material form, and expand the Material Composition and Properties section if necessary.

  2. Review the Effective Date for composition and properties information and select another one from the list when the default value does not apply.

    If the effective date is not listed, click New Effective Date to add it on the Material form.

  3. Expand the Composition subsection when necessary and click Add Component.

  4. Select a material Component from the list. Search by material name or CAS number.

  5. Select a SARA Activity from the list that represents the way the material is used at your facility.

    SARA activities are used to determine threshold exceedances for electronic TRI reporting and the form R. Refer to Determining Threshold Exceedances for additional information.

  6. Click the Requires two MW values check box when applicable.

    Molecular weight values are used in speciated VLE emission calculations. Refer to Speciation Method Emission Rate Determination and VLE Molecular Weight Speciation Configuration for additional information.

  7. Click the Trade Secret check box when applicable.

  8. Enter the concentration percentage in the Typical, Upper, and Minimum Concentration fields.

  9. Enter a percentage in the Vapor, Liquid, or Solid Concentration fields.

    If you entered a typical concentration, the same amount is automatically entered in the Sum Vapor, Liquid, or Solid field of the Composition subsection according to the Component Basis selected for the material. Enter values for the other two fields on the Material Component form and the entries will be applied to the appropriate Sum field(s).

  10. Click OK.

    The material component is displayed as a line item. Edit or delete existing material components using the buttons adjacent to the line item.

  11. Repeat steps 3 through 10 to add other material components.

  12. Click the Save button on the form.

Entering Physical Property Data for a Material

In the Physical Properties subsection of the Material Composition and Properties section on the Material form, enter results for physical properties of a material. Physical properties are characteristics of the material that are fixed, such as its boiling point, molecular weight, and liquid density.

Note:  A list of physical properties with base units of measure should already be displayed. If the material physical property you want is not listed, enter it on the Physical Properties form. Regardless of your selections on the Physical Properties form, physical properties are available for all Essential modules and materials.

For each physical property that applies to the material, enter the material's specific value. If the result is a number, enter a typical, maximum, and minimum value. To enter results in a unit of measure other than the physical property's base unit, select a new unit of measure from the list. The list will only contain units of the same unit type as the physical property's base unit (e.g., Temperature, Density, or Length) and for which there is conversion information to the base unit (on the Units of Measure form). For example, if the physical property is "Autoignition Temperature", the unit type is "Temperature", and the base unit of measure is "F", the unit could only be changed to C, K, R, or another unit that has conversion information to degrees F.

If the result for a physical property is not a number, enter a text-based value for it. For example, for the physical property "Appearance", the result might be the material's color. You should also document the analytical technique used to determine the result. If applicable, you can enter reference information for a physical property result. An example is the reference temperature for a specific gravity value.  

You may find that some physical properties are not applicable to the material. If you are not entering test results for a particular physical property, you can optionally document why the physical property was not tested by selecting a non-applicable reason.  

You can also assign a code that represents a text description for the physical property data in the Description field. An example of a physical property text description is "The specific gravity for the material was not determined, but it was assumed to be slightly less than water". Physical property descriptions are used for authored MSDSs and are validated on the Physical Property Descriptions form.  

Most physical property data is used for documentation and reporting. However, to calculate the response factor of any process streams, you must enter the molecular weight of each of its component materials. A user-defined Molecular Weight physical property can be specified for "Standard" and "Selective" speciation types when establishing material and material group emission calculations for your process unit emission models/scenarios. In the Waste module, default result values must be defined for the physical property Bulk Density when a volume unit of measure (e.g., gallons) is used to add waste to a container or to a shipment line. In the Industrial Hygiene module, the typical value defined for the physical property Health Hazard Rating is used for exposure assessment.

To add physical property data for a material

  1. Locate the material on the Materials list, click the material link to open the Material form, and expand the Material Composition and Properties section if necessary.

  2. Expand the Physical Properties subsection when necessary to view the list of physical properties and the corresponding base units of measure.

  3. Click the Edit button adjacent to a physical property line item and use the guidelines below to enter the Result value.

  1. Select the Analytical Technique that was used to test the physical property from the list.

    If the analytical technique is not listed, click the Ellipsis button to add it on the Material form.

  2. Click the N/A check box if the physical property was not tested. Select an associated non-applicable Reason from the list.

  3. Select a physical property Description code from the list.

    If the physical property is not listed, click the Ellipsis button to add it on the Material form.

  4. Click OK.

  5. Repeat steps 3 through 7 to edit other physical properties.

  6. Click the Save button on the form.

Adding Vapor Pressure Methods for a Material

In the Vapor Pressure Methods subsection of the Material Composition and Properties section on the Material form, you can select an estimation technique that should be used to determine the vapor pressure of a liquid or solid. For mixtures, an entry is not required. A mixture's vapor pressure can be calculated based on the data for its components using Raoult's Law.

Depending on which method you select, you may also be required to provide additional information for the calculation:

For the Air module, enter the emission stream temperature input for the various vapor pressure calculations on the Process Unit Emission Model form.

To add material vapor pressure methods

  1. Locate the material on the Materials list, click the material link to open the Material form, and expand the Material Composition and Properties section if necessary.

  2. Expand the Vapor Pressure Methods subsection and select an option for vapor pressure method:

  1. Click the Save button on the form.

Entering Vapor Pressure Data for a Material

In the Vapor Pressure subsection of the Material Composition and Properties section on the Material form, enter material vapor pressures and corresponding reference temperatures. To use this method, the Vapor Pressure Data option must be selected in the Vapor Pressure Methods subsection. For both the vapor pressure and the reference temperature, the corresponding unit of measure must be specified.  

To enter vapor pressure data

  1. Locate the material on the Materials list, click the material link to open the Material form, and expand the Material Composition and Properties section if necessary.

  2. Expand the Vapor Pressure Methods and Vapor Pressure subsections when necessary and verify the Vapor Pressure Data option has been selected in the Vapor Pressure Methods subsection.

  3. Click Add Vapor Pressure and enter a numeric value for the Vapor Pressure. This number must be greater than zero.

  4. Select a Unit of measure for the vapor pressure from the list. This list contains the units that are associated with the unit type Pressure.

    If the applicable unit is not listed, click the Ellipsis button and add it.

  5. Enter a numeric value in the Reference Temperature field.

  6. Select a Unit of measure for the reference temperature from the list. This list contains the units that are associated with unit type Temperature.

    If the unit is not listed, click the Ellipsis button and add it.

  7. Click OK.

    The information is displayed as a line item in the Vapor Pressure subsection. Edit existing vapor pressure information using the buttons adjacent to the line item.

  8. Repeat steps 3 through 7 to add other vapor pressures.

  9. Click the Save button on the form.

Assigning Physical States to a Material

Assign one or more physical state, such as vapor, to a material in the Physical States subsection of the Material Composition and Properties section on the Material form or the Waste Profile form. Before you begin, make sure you have validated a list of physical states on the Physical States form.

Material form

  1. Expand the Physical States subsection in the Material Composition and Properties section when necessary and click Add Physical States.

  2. Select the Available Physical States and click the right arrow button.

    If the physical state is not listed, click the Modify Physical States List button to add it to the Material form. To remove a physical state from the Assigned Physical States field, select it and click the left arrow button.

  3. Click the Save button on the form.

Waste Profile form

  1. Expand the Physical States subsection in the Material Composition and Properties section when necessary and click Add Physical States.

  2. Click the check box for each applicable state and click Add Physical States.

    Each physical state is displayed as a line item. Click the Delete button adjacent to the line item to remove the physical state.

  3. Click the Save button on the form.

Entering Minor Components for a Material

Specify a mixture material's trace components in the Minor Components subsection of the Material Composition and Properties section on the Material form. (Pure materials do not include minor components.) For example, a material might contain mercury in small amounts. Using the Minor Components subsection, you can specify the parts per million amount of mercury found in the material.

All minor components of a mixture must be pure. For each minor component, you can include three concentration values, typical, upper, and lower, along with the unit of measure. To document how the minor components were detected in a material, select a determination method and analytical technique.

By default, all minor components of a material will be reported when you generate a report. Designate a minor component as not applicable and it will not be included on reports.

Use the Comment field to add a description of the minor components. Remarks added here are often useful for future reference or to qualify a concentration value specified.

To enter minor components for a material

  1. Locate the material on the Materials list, click the material link to open the Material form, and expand the Material Composition and Properties section if necessary.

  2. Expand the Minor Component subsection when necessary and click Add Minor Component.

  3. Select a material from the Component field's list.

  4. Enter the concentration percentage in the Typical, Upper, and Minimum Concentration fields.

  5. Select a Unit of measure for the concentration values entered.

    If the unit is not listed, click the Ellipsis button to add it.

  6. Click the Not Applicable check box when the minor component should not be included on reports.

  7. Select a Determination Method from the list.

  8. Select an Analytical Technique from the list.

    If the analytical technique is not listed, click the Ellipsis button to add it on the Material form.

  9. Add any notes in the Comment field.

  10. Click OK.

    The minor component is displayed in a line item. Edit or delete existing minor components using the buttons adjacent to the line item.

  11. Repeat steps 2 through 10 to add other minor components of the same material.

  12. Click the Save button on the form.