1-[5-Isopropyl-2-Methylphenyl]-2-Buten-1-One
[CAS# 93942-48-4]

Identification

• Name: 1-[5-Isopropyl-2-Methylphenyl]-2-Buten-1-One
• Synonyms: (E)-1-(5-Isopropyl-2-Methyl-Phenyl)But-2-En-1-One; (E)-1-(5-Isopropyl-2-Methylphenyl)But-2-En-1-One; (E)-1-(2-Methyl-5-Propan-2-Yl-Phenyl)But-2-En-1-One
• Molecular Formula: C₁₄H₁₈O
• Molecular Weight: 202.30
• CAS Registry Number: 93942-48-4
• EINECS: 300-601-0
• SMILES: C1=C(C(C)C)C=CC(=C1C(=O)\C=C\C)C
• InChI: 1S/C14H18O/c1-5-6-14(15)13-9-12(10(2)3)8-7-11(13)4/h5-10H,1-4H3/b6-5+
• InChIKey: LKGGURDBIFFQGN-AATRIKPKSA-N

Properties

• Density: 0.946g/cm³ (Cal.)
• Boiling point: 306.046°C at 760 mmHg (Cal.)
• Flash point: 127.112°C (Cal.)