1-Ethyl-3-(2-Methyl-2-Propanyl)-1H-Pyrazole-5-Carboxylic Acid
[CAS# 195447-83-7]

Identification

• Name: 1-Ethyl-3-(2-Methyl-2-Propanyl)-1H-Pyrazole-5-Carboxylic Acid
• Synonyms: 1H-PYRAZOLE-5-CARBOXYLICACID, 3-(1,1-DIMETHYLETHYL)-1-ETHYL-; 3-(tert-butyl)-1-ethyl-1H-pyrazole-5-carboxylic acid; 3-(TERT-BUTYL)-1-ETHYL-1H-PYRAZOLE-5-CARBOXYLICACID
• Molecular Formula: C₁₀H₁₆N₂O₂
• Molecular Weight: 196.25
• CAS Registry Number: 195447-83-7
• SMILES: O=C(O)c1cc(nn1CC)C(C)(C)C
• InChI: 1S/C10H16N2O2/c1-5-12-7(9(13)14)6-8(11-12)10(2,3)4/h6H,5H2,1-4H3,(H,13,14)
• InChIKey: QFWVPDWDBJUZJL-UHFFFAOYSA-N

Properties

• Density: 1.109g/cm³ (Cal.)
• Boiling point: 329.703°C at 760 mmHg (Cal.)
• Flash point: 153.199°C (Cal.)
• Refractive index: 1.529 (Cal.)