2,4-Dihydro-4,4,5-trimethyl-2-phenyl-3H-pyrazol-3-one
[CAS# 947-82-0]

Identification

• Name: 2,4-Dihydro-4,4,5-trimethyl-2-phenyl-3H-pyrazol-3-one
• Synonyms: 4,4,5-Trimethyl-2-Phenyl-Pyrazol-3-One; 4,4,5-Trimethyl-2-Phenyl-3-Pyrazolone; 4,4,5-Trimethyl-2-Phenyl-2,4-Dihydro-3H-Pyrazol-3-One
• Molecular Formula: C₁₂H₁₄N₂O
• Molecular Weight: 202.26
• CAS Registry Number: 947-82-0
• SMILES: C2=C(N1C(=O)C(C)(C)C(=N1)C)C=CC=C2
• InChI: 1S/C12H14N2O/c1-9-12(2,3)11(15)14(13-9)10-7-5-4-6-8-10/h4-8H,1-3H3
• InChIKey: MZYISAKYPPUWJG-UHFFFAOYSA-N

Properties

• Density: 1.097g/cm³ (Cal.)
• Boiling point: 332.45°C at 760 mmHg (Cal.)
• Flash point: 154.861°C (Cal.)