Registration Dossier
Registration Dossier
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EC number: 205-371-4 | CAS number: 139-66-2
Vapour pressure
Administrative data
Link to relevant study record(s)
- Endpoint:
- vapour pressure
- Type of information:
- calculation (if not (Q)SAR)
- Adequacy of study:
- key study
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- accepted calculation method
- Justification for type of information:
- Data is from predictive models.
- Qualifier:
- according to guideline
- Guideline:
- other: Estimated data
- Principles of method if other than guideline:
- The Modified Grain Method was used to estimate vapour pressure of Diphenyl sulphide using MPBPVP (v1.43) Program of EPI Suite.
- GLP compliance:
- not specified
- Type of method:
- other: Modified Grain Method
- Specific details on test material used for the study:
- Name of test material (as cited in study report): Diphenyl sulphide
Molecular formula:C12H10S
Molecular weight:186.277 g/mol
Smiles : c1(Sc2ccccc2)ccccc1
InChI : 1S/C12H10S/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10H
Substance Type: Organic
Physical State: Liquid - Test no.:
- #1
- Temp.:
- 25 °C
- Vapour pressure:
- 0.322 Pa
- Remarks on result:
- other: Estimated via Modified Grain Method
- Conclusions:
- The vapor pressure of Diphenyl sulphide was estimated to be 0.322 Pa (0.00241 mm Hg) at 25 deg C.
- Executive summary:
The Modified Grain method was used to estimate the vapour pressure of Diphenyl sulphide using MPBPVP v1.43 Program of EPI SUITE. The vapor pressure of Diphenyl sulphide (CAS No. 139-66-2) was estimated to be 0.322 Pa (0.00241 mm Hg) at 25 deg C.
Reference
Description of key information
The vapor pressure of Diphenyl sulphide was estimated to be 0.322 Pa (0.00241 mm Hg) at 25 deg C.
Key value for chemical safety assessment
- Vapour pressure:
- 0.322 Pa
- at the temperature of:
- 25 °C
Additional information
The Modified Grain method was used to estimate the vapour pressure of Diphenyl sulphide using MPBPVP v1.43 Program of EPI SUITE. The vapor pressure of Diphenyl sulphide (CAS No. 139-66-2) was estimated to be 0.322 Pa (0.00241 mm Hg) at 25 deg C.
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