(2,3-Difluoro-4-propylphenyl)boronic acid
Basic information
- CAS
844699-71-4- Standard SMILES
CCCc1ccc(B(O)O)c(F)c1F- InChIKey
ZOJPSSJWKKPQDM-UHFFFAOYSA-N- Molecular formula
- C9H11BF2O2
- Average molar mass
- 199.99 g/mol
- Monoisotopic mass
- 200.0820161
Names & identifiers
- Preferred name
- (2,3-Difluoro-4-propylphenyl)boronic acid
- IUPAC
- (2,3-difluoro-4-propylphenyl)boronic acid
- English name
- Boronic acid, (2,3-difluoro-4-propylphenyl)- (9CI)
- Molecular formula
- C9H11BF2O2
- Molecular weight
- 199.9902464
Names & synonyms
(2,3-difluoro-4-propylphenyl)boronic acid844699-71-4starbld0018531(2,3-Difluoro-4-propylphenyl)-boronic acid2,3-DIFLUORO-4-PROPYLPHENYLBORONIC ACIDSCHEMBL5405156SCHEMBL29951783DTXSID40587345ZOJPSSJWKKPQDM-UHFFFAOYSA-NBoronic acid, (2,3-difluoro-4-propylphenyl)- (9CI)
Database identifiers
- CAS
844699-71-4- PubChem CID
- 16719982
- DTXSID
DTXSID40587345
Properties
Computed structural properties
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 180
Related reactions
1 records
Compound notes
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