Basic information
- Standard SMILES
CCCCCCC1CCC(c2ccc(C(=O)OC3CCC(C(F)(F)F)CC3)cc2)CC1- InChIKey
LEOGIYDPQIXTHH-UHFFFAOYSA-N- Molecular formula
- C26H37F3O2
- Average molar mass
- 438.6 g/mol
- Monoisotopic mass
- 438.2745649
Names & identifiers
- Preferred name
- 4-(Trifluoromethyl)cyclohexyl 4-(4-hexylcyclohexyl)benzoate
- IUPAC
- [4-(trifluoromethyl)cyclohexyl] 4-(4-hexylcyclohexyl)benzoate
Names & synonyms
4-(trifluoromethyl)cyclohexyl 4-(4-hexylcyclohexyl)benzoate6cHBzotFMecHDTXSID601381760
Database identifiers
- PubChem CID
- 175685369
- DTXSID
DTXSID601381760
Properties
Computed structural properties
- XLogP
- 9.9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 523
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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