3-(4-Methylphenyl)-1H-pyrazole-5-carboxylic acid
[CAS# 890007-12-2]

Identification

• Name: 3-(4-Methylphenyl)-1H-pyrazole-5-carboxylic acid
• Synonyms: 3-(4-METHYLPHENYL)-1H-PYRAZOLE-5-CARBOXYLICACID; 3-(4-methylphenyl)pyrazole-5-carboxylic acid; 3-(p-tolyl)-1H-pyrazole-5-carboxylic acid
• Molecular Formula: C₁₁H₁₀N₂O₂
• Molecular Weight: 202.21
• CAS Registry Number: 890007-12-2
• SMILES: CC1=CC=C(C=C1)C2=NNC(=C2)C(=O)O
• InChI: 1S/C11H10N2O2/c1-7-2-4-8(5-3-7)9-6-10(11(14)15)13-12-9/h2-6H,1H3,(H,12,13)(H,14,15)
• InChIKey: BGTWUOQARPOYER-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 489.6±33.0°C at 760 mmHg (Cal.)
• Flash point: 249.9±25.4°C (Cal.)
• Refractive index: 1.629 (Cal.)

Safety Data

• Safety Description: IRRITANT