5-Methyl-2-(2-Methyl-2-Propanyl)-1,2-Dihydro-3H-Pyrazol-3-One
[CAS# 277299-79-3]

Identification

• Name: 5-Methyl-2-(2-Methyl-2-Propanyl)-1,2-Dihydro-3H-Pyrazol-3-One
• Synonyms: 2-(tert-butyl)-5-methyl-1H-pyrazol-3(2H)-one
• Molecular Formula: C₈H₁₄N₂O
• Molecular Weight: 154.21
• CAS Registry Number: 277299-79-3
• SMILES: O=C1\C=C(\C)NN1C(C)(C)C
• InChI: 1S/C8H14N2O/c1-6-5-7(11)10(9-6)8(2,3)4/h5,9H,1-4H3
• InChIKey: RREYSSHMJXJLJM-UHFFFAOYSA-N

Properties

• Density: 1.029g/cm³ (Cal.)
• Boiling point: 204.539°C at 760 mmHg (Cal.)
• Flash point: 77.503°C (Cal.)
• Refractive index: 1.491 (Cal.)