Basic information
- CAS
872495-82-4- Standard SMILES
O[B]C=Cc1cc(F)cc(F)c1- InChIKey
UAUOXNQIWWCHNH-UHFFFAOYSA-N- Molecular formula
- C8H6BF2O
- Average molar mass
- 166.94 g/mol
- Monoisotopic mass
- 167.0479763
Names & identifiers
- Preferred name
- [2-(3,5-Difluorophenyl)ethenyl](hydroxy)boranyl
- IUPAC
- [2-(3,5-Difluorophenyl)ethenyl](hydroxy)boranyl
Names & synonyms
[2-(3,5-Difluorophenyl)ethenyl](hydroxy)boranyl
Database identifiers
- CAS
872495-82-4- PubChem CID
- 69337151
- DTXSID
DTXSID50740262
Properties
Computed structural properties
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 153
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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