2-[(1-Methyl-1H-pyrazol-5-yl)carbamoyl]benzoic acid
[CAS# 678967-82-3]

Identification

• Name: 2-[(1-Methyl-1H-pyrazol-5-yl)carbamoyl]benzoic acid
• Synonyms: 2-((1-methyl-1H-pyrazol-5-yl)carbamoyl)benzoic acid
• Molecular Formula: C₁₂H₁₁N₃O₃
• Molecular Weight: 245.23
• CAS Registry Number: 678967-82-3
• SMILES: O=C(Nc1ccnn1C)c2ccccc2C(=O)O
• InChI: 1S/C12H11N3O3/c1-15-10(6-7-13-15)14-11(16)8-4-2-3-5-9(8)12(17)18/h2-7H,1H3,(H,14,16)(H,17,18)
• InChIKey: DXMVKAUNEOGSBX-UHFFFAOYSA-N

Properties

• Density: 1.362g/cm³ (Cal.)
• Boiling point: 388.965°C at 760 mmHg (Cal.)
• Flash point: 189.04°C (Cal.)
• Refractive index: 1.644 (Cal.)