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EC number: 218-691-4 | CAS number: 2216-52-6
Surface tension
Administrative data
Link to relevant study record(s)
- Endpoint:
- surface tension
- 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:
- Estimated data from ACD Labs.
- Qualifier:
- according to guideline
- Guideline:
- other: Estimated data
- Principles of method if other than guideline:
- ACD/I-Lab accepts smiles of (+)-Neomenthol and estimated data for surface tension using v12.1.0.50375.
- GLP compliance:
- not specified
- Type of method:
- other: Estimated data
- Specific details on test material used for the study:
- - Name of the test chemical : (1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexan-1-ol- Common Name : (+)-Neomenthol- Molecular formula : C10H20O- Molecular weight : 156.267 g/mol- Smiles notation : C[C@@H]1CC[C@H]([C@H](C1)O)C(C)C- InChl : 1S/C10H20O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-11H,4-6H2,1-3H3/t8-,9+,10+/m1/s1- Substance type : Organic- Physical state : Liquid
- Key result
- Surface tension:
- 29.7 mN/m
- Remarks on result:
- other: no other details available
- Conclusions:
- Based on the data from ACD labs, surface tension for (+)-Neomenthol was predicted to be 29.7 mN/m.
- Executive summary:
Based on the data from ACD labs, surface tension for (+)-Neomenthol was predicted to be 29.7 mN/m.
Reference
Description of key information
Based on the data from ACD labs, surface tension for (+)-Neomenthol was predicted to be 29.7 mN/m.
Key value for chemical safety assessment
- Surface tension:
- 29.7
Additional information
Based on the data from ACD labs, surface tension for (+)-Neomenthol was predicted to be 29.7 mN/m.
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