Basic information
- CAS
41315-18-8- Standard SMILES
O=C(O)C1(c2ccc(C3CCCCC3)c(Cl)c2)CCCCC1- InChIKey
IFWUDZLEHZDKDS-UHFFFAOYSA-N- Molecular formula
- C19H25ClO2
- Average molar mass
- 320.9 g/mol
- Monoisotopic mass
- 320.1543077
Names & identifiers
- Preferred name
- Cyclohexanecarboxylic acid, 1-(3-chloro-4-cyclohexylphenyl)-
- IUPAC
- 1-(3-chloro-4-cyclohexylphenyl)cyclohexane-1-carboxylic acid
Names & synonyms
1-(3-Chloro-4-cyclohexylphenyl)cyclohexanecarboxylic acidTAI-40241315-18-8Cyclohexanecarboxylic acid, 1-(3-chloro-4-cyclohexylphenyl)-DTXSID30194289RefChem:335306DTXCID901167802~3~-Chloro-1~3~,1~4~,1~5~,1~6~,3~1~,3~2~,3~3~,3~4~,3~5~,3~6~-decahydro[1~1~,2~1~:2~4~,3~1~-terphenyl]-1~1~(1~2~H)-carboxylic acid
Database identifiers
- CAS
41315-18-8- PubChem CID
- 218941
- DTXSID
DTXSID30194289
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 383
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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