Basic information
- CAS
1236554-57-6- Standard SMILES
CCCC1CCC(c2cc(F)c(-c3ccc(OC(F)C(F)(F)F)c(F)c3)c(F)c2)CC1- InChIKey
YASLCAZUCLOEOV-UHFFFAOYSA-N- Molecular formula
- C23H23F7O
- Average molar mass
- 448.4 g/mol
- Monoisotopic mass
- 448.16371249
Names & identifiers
- Preferred name
- 3cHteFEtOtFB
- IUPAC
- 1,3-difluoro-2-[3-fluoro-4-(1,2,2,2-tetrafluoroethoxy)phenyl]-5-(4-propylcyclohexyl)benzene
Names & synonyms
3cHteFEtOtFBDTXSID8013779012,3',6-trifluoro-4-(4-propylcyclohexyl)-4'-(1,2,2,2-tetrafluoroethoxy)-1,1'-biphenyl1,1a(2)-Biphenyl, 2,3a(2),6-trifluoro-4-(4-propylcyclohexyl)-4a(2)-(1,2,2,2-tetrafluoroethoxy)-1236554-57-6
Database identifiers
- CAS
1236554-57-6- PubChem CID
- 175686244
- DTXSID
DTXSID801377901
Properties
Computed structural properties
- XLogP
- 9.3
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 537
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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