Basic information
- CAS
431065-59-7- Standard SMILES
CCCCC1CCC(C2CCC(C(F)(F)Oc3ccc(F)c(F)c3)CC2)CC1- InChIKey
ZMHZLDKETXZUDN-UHFFFAOYSA-N- Molecular formula
- C23H32F4O
- Average molar mass
- 400.5 g/mol
- Monoisotopic mass
- 400.23892829
Names & identifiers
- Preferred name
- dFPO-CF2-4bcH
- IUPAC
- 4-[[4-(4-butylcyclohexyl)cyclohexyl]-difluoromethoxy]-1,2-difluorobenzene
Names & synonyms
dFPO-CF2-4bcHDTXSID6013801864-butyl-4'-((3,4-difluorophenoxy)difluoromethyl)-1,1'-bi(cyclohexane)4-[[(trans,trans)-4a(2)-Butyl[1,1a(2)-bicyclohexyl]-4-yl]difluoromethoxy]-1,2-difluorobenzene431065-59-7
Database identifiers
- CAS
431065-59-7- PubChem CID
- 175686344
- DTXSID
DTXSID601380186
Properties
Computed structural properties
- XLogP
- 9.6
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 456
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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