Basic information
- Standard SMILES
CCCC1CCC(CCC2CCC(c3ccccc3C(=O)Cl)CC2)CC1- InChIKey
OIJOLVSHHDXBKO-UHFFFAOYSA-N- Molecular formula
- C24H35ClO
- Average molar mass
- 375 g/mol
- Monoisotopic mass
- 374.2376434
Names & identifiers
- Preferred name
- (trans-4-(2-(trans-4-n-Propylcyclohexyl)ethyl)cyclohexyl)benzoylchloride
- IUPAC
- 2-[4-[2-(4-propylcyclohexyl)ethyl]cyclohexyl]benzoyl chloride
Names & synonyms
SCHEMBL8447616SCHEMBL8447619OIJOLVSHHDXBKO-IFSQOONMSA-N(trans-4-(2-(trans-4-n-propylcyclohexyl)ethyl)cyclohexyl)benzoylchloride
Database identifiers
- PubChem CID
- 54151978
Properties
Computed structural properties
- XLogP
- 9.8
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 418
Related reactions
1 records
Compound notes
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