(4S)-4-Allyl-4,5-dimethyl-2,4-dihydro-3H-pyrazol-3-one
[CAS# 935693-48-4]

Identification

• Name: (4S)-4-Allyl-4,5-dimethyl-2,4-dihydro-3H-pyrazol-3-one
• Synonyms: (S)-4-allyl-3,4-dimethyl-1H-pyrazol-5(4H)-one
• Molecular Formula: C₈H₁₂N₂O
• Molecular Weight: 152.19
• CAS Registry Number: 935693-48-4
• SMILES: CC1=NNC(=O)[C@@]1(C)CC=C
• InChI: 1S/C8H12N2O/c1-4-5-8(3)6(2)9-10-7(8)11/h4H,1,5H2,2-3H3,(H,10,11)/t8-/m0/s1
• InChIKey: CQOWEKIHKPQRTN-QMMMGPOBSA-N

Properties

• Density: 1.071g/cm³ (Cal.)
• Refractive index: 1.528 (Cal.)