2-Methyl-3-[(3-pyridinylmethyl)amino]benzoic acid
[CAS# 878714-39-7]

Identification

• Name: 2-Methyl-3-[(3-pyridinylmethyl)amino]benzoic acid
• Synonyms: 2-methyl-3-((pyridin-3-ylmethyl)amino)benzoic acid; 2-Methyl-3-(5-methyl-3-nitro-pyrazol-1-yl)-propionic acid; 2-methyl-3-[(3-pyridinylmethyl)amino]benzoic acid
• Molecular Formula: C₁₄H₁₄N₂O₂
• Molecular Weight: 242.27
• CAS Registry Number: 878714-39-7
• SMILES: CC1=C(C=CC=C1NCC2=CN=CC=C2)C(=O)O
• InChI: 1S/C14H14N2O2/c1-10-12(14(17)18)5-2-6-13(10)16-9-11-4-3-7-15-8-11/h2-8,16H,9H2,1H3,(H,17,18)
• InChIKey: NGXRKJYCGOTLFE-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 463.6±40.0°C at 760 mmHg (Cal.)
• Flash point: 234.2±27.3°C (Cal.)
• Refractive index: 1.654 (Cal.)

Safety Data

• Safety Description: IRRITANT