1H-Pyrazole-3-Carboxylicacid, Butylester
[CAS# 122609-00-1]

Identification

• Name: 1H-Pyrazole-3-Carboxylicacid, Butylester
• Synonyms: 2H-Pyrazole-3-Carboxylic Acid Butyl Ester
• Molecular Formula: C₈H₁₂N₂O₂
• Molecular Weight: 168.20
• CAS Registry Number: 122609-00-1
• SMILES: C1=C([NH]N=C1)C(OCCCC)=O
• InChI: 1S/C8H12N2O2/c1-2-3-6-12-8(11)7-4-5-9-10-7/h4-5H,2-3,6H2,1H3,(H,9,10)
• InChIKey: QFFIYHQSONBHJM-UHFFFAOYSA-N

Properties

• Density: 1.133g/cm³ (Cal.)
• Boiling point: 302.572°C at 760 mmHg (Cal.)
• Flash point: 136.791°C (Cal.)