2-[(2-Fluorophenyl)amino]nicotinic acid
Basic information
- CAS
57978-54-8- Standard SMILES
O=C(O)c1cccnc1Nc1ccccc1F- InChIKey
APJRFLHMLYOPJK-UHFFFAOYSA-N- Molecular formula
- C12H9FN2O2
- Average molar mass
- 232.21 g/mol
- Monoisotopic mass
- 232.0648057
Names & identifiers
- Preferred name
- 2-[(2-Fluorophenyl)amino]nicotinic acid
- IUPAC
- 2-(2-fluoroanilino)pyridine-3-carboxylic acid
- English name
- 2-[(2-Fluorophenyl)amino]nicotinic acid
- Molecular formula
- C12H9FN2O2
- Molecular weight
- 232.21
Names & synonyms
57978-54-82-[(2-fluorophenyl)amino]nicotinic acid2-(2-fluoroanilino)pyridine-3-carboxylic acid2-[(2-fluorophenyl)amino]pyridine-3-carboxylic Acid2-((2-Fluorophenyl)amino)nicotinic acid3-Pyridinecarboxylic acid, 2-[(2-fluorophenyl)amino]-MFCD04621499SCHEMBL9471929DTXSID00368455APJRFLHMLYOPJK-UHFFFAOYSA-NALBB-0290112-(2-Fluorophenylamino)nicotinic acid
Show more names
2-[(2-fluorophenyl)amino]-3-pyridinecarboxylic acid
AKOS000118718CCG-356578SB811312-((2-Fluorophenyl)amino)nicotinicacidLS-100932-[(2-fluorophenyl)-amino]-nicotinic acidDB-408793EN300-08142
Database identifiers
- CAS
57978-54-8- PubChem CID
- 2393555
- DTXSID
DTXSID00368455- Nikkaji
- J2.851.748C
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 62.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 275
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Suppliers
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Related reactions
2 records
Compound notes
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