4-Methoxyphenyl 2,6-difluoro-4-(4-hexylcyclohexyl)benzoate
Basic information
- Standard SMILES
CCCCCCC1CCC(c2cc(F)c(C(=O)Oc3ccc(OC)cc3)c(F)c2)CC1- InChIKey
WRBQNIDJVPOJKA-UHFFFAOYSA-N- Molecular formula
- C26H32F2O3
- Average molar mass
- 430.5 g/mol
- Monoisotopic mass
- 430.2319512
Names & identifiers
- Preferred name
- 4-Methoxyphenyl 2,6-difluoro-4-(4-hexylcyclohexyl)benzoate
- IUPAC
- (4-methoxyphenyl) 2,6-difluoro-4-(4-hexylcyclohexyl)benzoate
Names & synonyms
4-methoxyphenyl 2,6-difluoro-4-(4-hexylcyclohexyl)benzoate6cHdFBzoMeOPDTXSID901381783
Database identifiers
- PubChem CID
- 175686119
- DTXSID
DTXSID901381783
Properties
Computed structural properties
- XLogP
- 9
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 515
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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