Basic information
- CAS
140705-30-2- Standard SMILES
CCCCCC1CCC(c2ccc(-c3cc(F)c(OC(F)(F)F)c(F)c3)cc2)CC1- InChIKey
VCTMNCSRDMFEOL-UHFFFAOYSA-N- Molecular formula
- C24H27F5O
- Average molar mass
- 426.5 g/mol
- Monoisotopic mass
- 426.19820629
Names & identifiers
- Preferred name
- 5cHtFMeOdFB
- IUPAC
- 1,3-difluoro-5-[4-(4-pentylcyclohexyl)phenyl]-2-(trifluoromethoxy)benzene
Names & synonyms
5cHtFMeOdFBDTXSID4013801783,5-difluoro-4'-(4-pentylcyclohexyl)-4-(trifluoromethoxy)-1,1'-biphenyltrans-3,5-difluoro-4a(2)-(4-pentylcyclohexyl)-4-(trifluoromethoxy)-1,1a(2)-Biphenyl140705-30-2
Database identifiers
- CAS
140705-30-2- PubChem CID
- 175686006
- DTXSID
DTXSID401380178
Properties
Computed structural properties
- XLogP
- 9.9
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 482
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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