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Physical & Chemical properties

Surface tension

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Reference
Endpoint:
surface tension
Type of information:
other: Predicted data
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
other: Predicted data
Qualifier:
according to
Guideline:
other: as mentioned below
Principles of method if other than guideline:
ACD/I-Lab accepts smiles of test item and predicted data for surface tension using v12.1.0.50375.
GLP compliance:
not specified
Specific details on test material used for the study:
- Name of test material (as cited in study report): butyl 12-acetoxyoctadec-9-enoate
- Molecular formula: C24 H44 O4
- Molecular weight: 396.6076 g/mol
- Substance type: Organic
- Smiles: CCCCCC[C@H](C\C=C/CCCCCCCC(=O)OCCCC)OC(=O)C
- InChI: 1S/C24H44O4/c1-4-6-8-15-18-23(28-22(3)25)19-16-13-11-9-10-12-14-17-20-24(26)27-21-7-5-2/h13,16,23H,4-12,14-15,17-21H2,1-3H3/b16-13-/t23-/m1/s1
- Physical state: Liquid
Surface tension:
33.1 other: dyne/cm
Remarks on result:
other: no other details available
Conclusions:
Based on the data from ACD labs, surface tension for butyl 12-acetoxyoctadec-9-enoate was predicted to be 33.1 ± 3.0 dyne/cm.
Executive summary:

Based on the data from ACD labs, surface tension for butyl 12-acetoxyoctadec-9-enoate was predicted to be 33.1 ± 3.0 dyne/cm.

Description of key information

Based on the data from ACD labs, surface tension for butyl 12-acetoxyoctadec-9-enoate was predicted to be 33.1 ± 3.0 dyne/cm.

Key value for chemical safety assessment

Surface tension:
33.1

Additional information

Based on the data from ACD labs, surface tension for butyl 12-acetoxyoctadec-9-enoate was predicted to be 33.1 ± 3.0 dyne/cm.