(3-Fluoroisoquinolin-6-yl)boronic acid
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Basic information
- Standard SMILES
OB(O)c1ccc2cnc(F)cc2c1- InChIKey
ZHHNXWLNMLXBEO-UHFFFAOYSA-N- Molecular formula
- C9H7BFNO2
- Average molar mass
- 190.97 g/mol
Names & identifiers
- Preferred name
- (3-Fluoroisoquinolin-6-yl)boronic acid
- IUPAC
- (3-fluoroisoquinolin-6-yl)boronic acid
Names & synonyms
(3-fluoroisoquinolin-6-yl)boronic acid1105710-34-63-Fluoroisoquinoline-6-boronic AcidBoronic acid, B-(3-fluoro-6-isoquinolinyl)-SCHEMBL1519795ZHHNXWLNMLXBEO-UHFFFAOYSA-N3-Fluoroisoquinolin-6-ylboronic acidDA-35276
Database identifiers
- PubChem CID
- 58488201
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 53.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 205
Related reactions
1 records
Compound notes
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