2-Chloro-1-(4-methylphenyl)-3-buten-1-one
[CAS# 77131-96-5]

Identification

• Name: 2-Chloro-1-(4-methylphenyl)-3-buten-1-one
• Synonyms: 2-chloro-1-(p-tolyl)but-3-en-1-one
• Molecular Formula: C₁₁H₁₁ClO
• Molecular Weight: 194.66
• CAS Registry Number: 77131-96-5
• SMILES: Cc1ccc(cc1)C(=O)C(C=C)Cl
• InChI: 1S/C11H11ClO/c1-3-10(12)11(13)9-6-4-8(2)5-7-9/h3-7,10H,1H2,2H3
• InChIKey: BETZWSXQBLDBRK-UHFFFAOYSA-N

Properties

• Density: 1.099g/cm³ (Cal.)
• Boiling point: 299.307°C at 760 mmHg (Cal.)
• Flash point: 157.374°C (Cal.)