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Physical & Chemical properties

Vapour pressure

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Reference
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 modelling database
Reference:
Composition 1
Composition 2
Composition 3
Qualifier:
according to
Guideline:
other: estimated data
Principles of method if other than guideline:
MPBPVP v1.43 was used to estimate the vapour pressure of substance Geranyl phenylacetate.
GLP compliance:
not specified
Type of method:
other: estimated data
Test material information:
Composition 1
Specific details on test material used for the study:
Name of the test chemical: (2E)-3,7-dimethylocta-2,6-dien-1-yl 2-phenylacetate/ Geranyl phenylacetate
Molecular formula: C18H24O2
Molecular weight: 272.3856 g/mol
Smiles Notation: c1(CC(OC\C=C(\CC\C=C(\C)C)C)=O)ccccc1
InChI: 1S/C18H24O2/c1-15(2)8-7-9-16(3)12-13-20-18(19)14-17-10-5-4-6-11-17/h4-6,8,10-12H,7,9,13-14H2,1-3H3/b16-12+
Substance Type: Organic
Physical State: Liquid (Colorless)
Key result
Test no.:
#1
Temp.:
25 °C
Vapour pressure:
0.007 Pa
Remarks on result:
other: no other details mentioned
Conclusions:
The estimated vapour pressure of the substance Geranyl phenylacetate at 25 deg C was 0.007053 Pa.
Executive summary:

Modified Grain method (Mean of Antoine and Modified Grain methods) was used to estimate the vapour pressure of the substance Geranyl phenylacetate using MPBPVP v1.43 of EPI SUITE.

The estimated vapour pressure of the substance Geranyl phenylacetate at 25 deg C was 0.007053 Pa.

Description of key information

The estimated vapour pressure of the substance Geranyl phenylacetate at 25 deg C was 0.007053 Pa.

Key value for chemical safety assessment

Vapour pressure:
0.007 Pa
at the temperature of:
25 °C

Additional information

Modified Grain method (Mean of Antoine and Modified Grain methods) was used to estimate the vapour pressure of the substance Geranyl phenylacetate using MPBPVP v1.43 of EPI SUITE.

The estimated vapour pressure of the substance Geranyl phenylacetate at 25 deg C was 0.007053 Pa.