4-(3,5-Dimethyl-1H-Pyrazol-4-Yl)Benzoic Acid
[CAS# 185252-69-1]

Identification

• Name: 4-(3,5-Dimethyl-1H-Pyrazol-4-Yl)Benzoic Acid
• Synonyms: BENZOIC ACID, 4-(3,5-DIMETHYL-1H-PYRAZOL-4-YL)-
• Molecular Formula: C₁₂H₁₂N₂O₂
• Molecular Weight: 216.24
• CAS Registry Number: 185252-69-1
• SMILES: Cc1c(c(n[nH]1)C)c2ccc(cc2)C(=O)O
• InChI: 1S/C12H12N2O2/c1-7-11(8(2)14-13-7)9-3-5-10(6-4-9)12(15)16/h3-6H,1-2H3,(H,13,14)(H,15,16)
• InChIKey: JYRIFOAFECWGHB-UHFFFAOYSA-N

Properties

• Density: 1.262g/cm³ (Cal.)
• Boiling point: 420.84°C at 760 mmHg (Cal.)
• Flash point: 208.317°C (Cal.)
• Refractive index: 1.617 (Cal.)