Basic information
- Standard SMILES
CCCCCCc1ccc(C(=O)Oc2ccc(C)c(F)c2)c(F)c1- InChIKey
LIPRLUDKMROFEM-UHFFFAOYSA-N- Molecular formula
- C20H22F2O2
- Average molar mass
- 332.4 g/mol
- Monoisotopic mass
- 332.15878626
Names & identifiers
- Preferred name
- 3-Fluoro-4-methylphenyl 2-fluoro-4-hexylbenzoate
- IUPAC
- (3-fluoro-4-methylphenyl) 2-fluoro-4-hexylbenzoate
Names & synonyms
3-fluoro-4-methylphenyl 2-fluoro-4-hexylbenzoate6FBzoFMePDTXSID201381687
Database identifiers
- PubChem CID
- 175685379
- DTXSID
DTXSID201381687
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 388
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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