BetFEtOdFB
Basic information
- Standard SMILES
C=CCCc1ccc(-c2ccc(OCC(F)(F)F)c(F)c2F)cc1- InChIKey
FLJQJVLCBUFHOT-UHFFFAOYSA-N- Molecular formula
- C18H15F5O
- Average molar mass
- 342.3 g/mol
- Monoisotopic mass
- 342.10430591
Names & identifiers
- Preferred name
- BetFEtOdFB
- IUPAC
- 1-(4-but-3-enylphenyl)-2,3-difluoro-4-(2,2,2-trifluoroethoxy)benzene
Names & synonyms
BetFEtOdFBDTXSID1013798754'-(but-3-en-1-yl)-2,3-difluoro-4-(2,2,2-trifluoroethoxy)biphenyl4'-(but-3-en-1-yl)-2,3-difluoro-4-(2,2,2-trifluoroethoxy)-1,1'-biphenyl
Database identifiers
- PubChem CID
- 175684943
- DTXSID
DTXSID101379875
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 389
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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