(3,5-Dimethyl-4-Nitro-1H-Pyrazol-1-Yl)Acetic Acid
[CAS# 345637-69-6]

Identification

• Name: (3,5-Dimethyl-4-Nitro-1H-Pyrazol-1-Yl)Acetic Acid
• Synonyms: (3,5-Dimethyl-4-nitropyrazol-1-yl)acetic acid; (3,5-Dimethyl-4-nitro-pyrazol-1-yl)-acetic acid; {4-nitro-3,5-dimethyl-1H-pyrazol-1-yl}acetic acid
• Molecular Formula: C₇H₉N₃O₄
• Molecular Weight: 199.16
• CAS Registry Number: 345637-69-6
• SMILES: CC1=C(C(=NN1CC(=O)O)C)[N+](=O)[O-]
• InChI: 1S/C7H9N3O4/c1-4-7(10(13)14)5(2)9(8-4)3-6(11)12/h3H2,1-2H3,(H,11,12)
• InChIKey: BFNTYPOJGJVSTK-UHFFFAOYSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Boiling point: 387.6±42.0°C at 760 mmHg (Cal.)
• Flash point: 188.2±27.9°C (Cal.)
• Refractive index: 1.627 (Cal.)

Safety Data

• Safety Description: IRRITANT