BRN 5097991

2-[(2-chloropyridine-3-carbonyl)amino]-3-phenylpropanoic acid

CAS: 76980-23-9

Molecular Formula	`C15H13ClN2O3`
Molecular Weight	304.73 g/mol
LogP	2.7
Topological Polar Surface Area	79.3 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	5
Exact Mass	304.06146
Heavy Atoms	21
Complexity	372.0

Chemical Identifiers

CAS Number	76980-23-9
SMILES	`C1=CC=C(C=C1)CC(C(=O)O)NC(=O)C2=C(N=CC=C2)Cl`
InChIKey	`XYXVAIJEBDFXQB-UHFFFAOYSA-N`

📖 Product Overview

BRN 5097991 (CAS: 76980-23-9) is a chemical compound with molecular formula C15H13ClN2O3 and molecular weight 304.73 g/mol. Its IUPAC systematic name is 2-[(2-chloropyridine-3-carbonyl)amino]-3-phenylpropanoic acid. LogP 2.7 Topological Polar Surface Area 79.3 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 5 Exact Mass 304.06146 Heavy Atoms 21 Complexity 372.0 InChI Key: XYXVAIJEBDFXQB-UHFFFAOYSA-N. SMILES: C1=CC=C(C=C1)CC(C(=O)O)NC(=O)C2=C(N=CC=C2)Cl.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.

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