Registration Dossier
Registration Dossier
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EC number: 201-166-9 | CAS number: 79-00-5
Henry's Law constant
Administrative data
- Endpoint:
- Henry's law constant
- Type of information:
- (Q)SAR
- Adequacy of study:
- supporting study
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- other: HENRYWIN is a module of the EPI suite made available by the US EPA
- Justification for type of information:
- QSAR prediction: migrated from IUCLID 5.6
Data source
Reference
- Reference Type:
- other: QSAR
- Title:
- HENRYWIN v 3.20
- Year:
- 2 008
- Bibliographic source:
- U.S. Environmental Protection Agency
Materials and methods
- Principles of method if other than guideline:
- QSAR
Test material
- Reference substance name:
- 1,1,2-trichloroethane
- EC Number:
- 201-166-9
- EC Name:
- 1,1,2-trichloroethane
- Cas Number:
- 79-00-5
- Molecular formula:
- C2H3Cl3
- IUPAC Name:
- 1,1,2-trichloroethane
Constituent 1
Results and discussion
Henry's Law constant Hopen allclose all
- H:
- 0.004 atm m³/mol
- Temp.:
- 25 °C
- H:
- 0 atm m³/mol
- Temp.:
- 25 °C
- H:
- 0.001 atm m³/mol
- Temp.:
- 25 °C
Any other information on results incl. tables
bond method: 4.27E-3 atm m³/mol
group method: 1.02 E-4 atm m³/mol
experimental database: 8.24 E-4 atm m³/mol
Applicant's summary and conclusion
- Conclusions:
- Depending on the method, the estimated Henry's law constant ranged from 1.02E-4 to 4.27E-3 atm m³/mol.
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