Basic information
- CAS
174806-77-0- Standard SMILES
CCCC1CCC(c2ccc(-c3ccc(OC(F)(F)F)c(F)c3)c(F)c2)CC1- InChIKey
BNXHYGOONARFOZ-UHFFFAOYSA-N- Molecular formula
- C22H23F5O
- Average molar mass
- 398.4 g/mol
- Monoisotopic mass
- 398.16690616
Names & identifiers
- Preferred name
- 3cHtFMeOFPFP
- IUPAC
- 2-fluoro-1-[3-fluoro-4-(trifluoromethoxy)phenyl]-4-(4-propylcyclohexyl)benzene
Names & synonyms
3cHtFMeOFPFPDTXSID2013779032,3'-difluoro-4-(4-propylcyclohexyl)-4'-(trifluoromethoxy)-1,1'-biphenyl1,1a(2)-Biphenyl, 2,3a(2)-difluoro-4-(4-propylcyclohexyl)-4a(2)-(trifluoromethoxy)-, trans-174806-77-0
Database identifiers
- CAS
174806-77-0- PubChem CID
- 175684735
- DTXSID
DTXSID201377903
Properties
Computed structural properties
- XLogP
- 8.8
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 474
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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