Registration Dossier
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EC number: 604-582-2 | CAS number: 1472-93-1
Henry's Law constant
Administrative data
Link to relevant study record(s)
- Endpoint:
- Henry's law constant
- Type of information:
- (Q)SAR
- Remarks:
- estimated by calculation
- Adequacy of study:
- supporting study
- Study period:
- 2016
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- other: US EPA method
- Justification for type of information:
- SOFTWARE:
US EPA. Estimation Programs Interface Suite (EpiSuite) v4.11
MODEL (incl. version number):
HENRYWIN v3.20 (2011).
SMILES OR OTHER IDENTIFIERS USED AS INPUT FOR THE MODEL:
COC(=O)CCCCCCCCCCCCCCCCC(=O)OC
ADEQUACY OF THE RESULT:
Results considered suffiicent as supporting information in e-fate assessment. - Qualifier:
- no guideline required
- Principles of method if other than guideline:
- Hine, J. and Mookerjee, P.K. 1975. The intrinsic hydrophilic character of organic compounds. Correlations in terms of structural contributions. J. Org. Chem. 40: 292-298. The original methodology was updated and expanded by Syracuse Research Corporation as HENRYWIN v3.20 (2011).
- GLP compliance:
- no
- H:
- 0.007 atm m³/mol
- Temp.:
- 25 °C
- Atm. press.:
- 1 atm
- Remarks on result:
- other: Estimated using available water solubility and vapor pressure data
- Conclusions:
- The Henry's Law Constant for octadecanedioic acid, 1,18-dimethyl ester (ODDAME) is estimated to be 6.585E-003 atm-m3/mole 25 °C by using HENRYWIN v3.20 and available water solubility and vapor pressure data.
Reference
Description of key information
Henry's Law Constant is estimated to be 6.585E-003 atm-m3/mole at 25°C.
Key value for chemical safety assessment
- Henry's law constant (H) (in Pa m³/mol):
- 0.007
- at the temperature of:
- 25 °C
Additional information
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.
Reproduction or further distribution of this information may be subject to copyright protection. Use of the information without obtaining the permission from the owner(s) of the respective information might violate the rights of the owner.
