(4-(Decyloxy)-2-fluorophenyl)boronic acid
Basic information
- CAS
175425-95-3- Standard SMILES
CCCCCCCCCCOc1ccc(B(O)O)c(F)c1- InChIKey
LMHUJPLLLBRKMX-UHFFFAOYSA-N- Molecular formula
- C16H26BFO3
- Average molar mass
- 296.2 g/mol
- Monoisotopic mass
- 296.195903
Names & identifiers
- Preferred name
- (4-(Decyloxy)-2-fluorophenyl)boronic acid
- IUPAC
- (4-decoxy-2-fluorophenyl)boronic acid
Names & synonyms
(4-(Decyloxy)-2-fluorophenyl)boronic acid175425-95-3[4-(Decyloxy)-2-fluorophenyl]boronic acidstarbld0019263SCHEMBL8209170DTXSID90708609AKOS014537543
Database identifiers
- CAS
175425-95-3- PubChem CID
- 54040976
- DTXSID
DTXSID90708609
Properties
Computed structural properties
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 11
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 254
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…