3-Amino-4-[(Pyridin-3-Ylmethyl)-Amino]-Benzoic Acid
[CAS# 436088-89-0]

Identification

• Name: 3-Amino-4-[(Pyridin-3-Ylmethyl)-Amino]-Benzoic Acid
• Synonyms: 3-Amino-4-(3-Pyridylmethylamino)Benzoate; Zinc00319713
• Molecular Formula: C₁₃H₁₂N₃O₂
• Molecular Weight: 242.26
• CAS Registry Number: 436088-89-0
• SMILES: C1=C(C=CC(=C1N)NCC2=CC=CN=C2)C([O-])=O
• InChI: 1S/C13H13N3O2/c14-11-6-10(13(17)18)3-4-12(11)16-8-9-2-1-5-15-7-9/h1-7,16H,8,14H2,(H,17,18)/p-1
• InChIKey: MHWWFBSFFVDUPF-UHFFFAOYSA-M

Properties

• Boiling point: 500.709°C at 760 mmHg (Cal.)
• Flash point: 256.62°C (Cal.)