Basic information
- CAS
222986-74-5- Standard SMILES
Cl.O=C(O)c1ccc(-c2ccccn2)cc1- InChIKey
BMVYFDQFGGMZLY-UHFFFAOYSA-N- Molecular formula
- C12H10ClNO2
- Average molar mass
- 235.66 g/mol
Names & identifiers
- Preferred name
- 4-(2-Pyridyl)benzoic acid hydrochloride
- IUPAC
- 4-pyridin-2-ylbenzoic acid;hydrochloride
Names & synonyms
4-(2-pyridyl)benzoic acid hydrochloride222986-74-5SCHEMBL3066744BMVYFDQFGGMZLY-UHFFFAOYSA-N4-pyridin-2-yl-benzoic acid hydrochloride4-(pyridin-2-yl)benzoic acid hydrochlorideDB-194759
Database identifiers
- CAS
222986-74-5- PubChem CID
- 68499643
Properties
Computed structural properties
- Topological polar surface area
- 50.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 222
Related reactions
5 records
Compound notes
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