Registration Dossier

Diss Factsheets

Administrative data

Endpoint:
Henry's law constant
Type of information:
calculation (if not (Q)SAR)
Remarks:
Migrated phrase: estimated by calculation
Adequacy of study:
key study
Study period:
2010-09-09
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
other: Following the formula in EUSES

Data source

Materials and methods

GLP compliance:
no

Test material

Constituent 1
Chemical structure
Reference substance name:
Methyl 3-oxo-2-pentylcyclopentaneacetate
EC Number:
246-495-9
EC Name:
Methyl 3-oxo-2-pentylcyclopentaneacetate
Cas Number:
24851-98-7
Molecular formula:
C13H22O3
IUPAC Name:
methyl 3-oxo-2-pentylcyclopentaneacetate
Details on test material:
- Smiles notation : O=C(OC)CC(C(C(=O)C1)CCCCC)C1

Results and discussion

Henry's Law constant H
H:
ca. 0 Pa m³/mol
Remarks on result:
other: The Temperature and the pressure were not available.

Applicant's summary and conclusion

Conclusions:
The Henry's constant is 8.48 10-5 Pa m3/mol.
Executive summary:

The calculated Henry's constant for the test material is 8.48 10-5 Pa m3/mol.