Registration Dossier
Registration Dossier
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EC number: 939-415-5 | CAS number: -
Henry's Law constant
Administrative data
Link to relevant study record(s)
- Endpoint:
- Henry's law constant
- Type of information:
- (Q)SAR
- Adequacy of study:
- key study
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- other: Calculation based on a measured water solubility value and vapour pressure
- Principles of method if other than guideline:
- Calculated from the measured water solubility and vapour pressure
- GLP compliance:
- no
- Key result
- H:
- 0.001 Pa m³/mol
- Temp.:
- 25 °C
- Executive summary:
Henry's law constant for the analogue substance was calculated to be 8.7E-04 Pa.m3/mol at 25 °C based on experimental water solubility and vapour pressures . This value indicates a low rate of volatilisation from surface water is expected.
- Endpoint:
- Henry's law constant
- Type of information:
- read-across from supporting substance (structural analogue or surrogate)
- Adequacy of study:
- key study
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- other: analogue substance
- Justification for type of information:
- Calculation of Henry’s Law constant is not required because available data indicate that structural variation does not influence test results or adverse effect profile (see read-across and category justifications attached in Section 13).
- Reason / purpose for cross-reference:
- read-across source
- H:
- 0.001 Pa m³/mol
- Temp.:
- 25 °C
Referenceopen allclose all
Description of key information
Henry's law constant for the analogue substance was calculated to be 8.7E-04Pa.m3/mol at 25 °C based on experimental water solubility and vapour pressures. This value indicates a low rate of volatilisation from surface water is expected.
Key value for chemical safety assessment
- Henry's law constant (H) (in Pa m³/mol):
- 0.001
- at the temperature of:
- 25 °C
Additional information
There is no specific data on the substance. Read-across to the physico-chemical properties of Hexanoic acid, 3,5,5-trimethyl-, 1,1'-[2-ethyl-2-[[(3,5,5-trimethyl-1-oxohexyl)oxy]methyl]-1,3-propanediyl] ester (EC 613-848-7, CAS65870-94-2) is applicable based on the similarity in structure and physico-chemical properties. The justification for read-across is presented in Section 13 Assessment reports- Read-across justification.
Henry's law constant for the analogue substance was calculated to be 8.7E-04 Pa.m3/mol at 25 °C based on experimental water solubility and vapour pressures . This value indicates a low rate of volatilisation from surface water is expected.
Information on Registered Substances comes from registration dossiers which have been assigned a registration number. The assignment of a registration number does however not guarantee that the information in the dossier is correct or that the dossier is compliant with Regulation (EC) No 1907/2006 (the REACH Regulation). This information has not been reviewed or verified by the Agency or any other authority. The content is subject to change without prior notice.
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