1-(4-Bromo-3-methylphenyl)-7-chloro-1-heptanone
[CAS# 898760-98-0]

Identification

• Name: 1-(4-Bromo-3-methylphenyl)-7-chloro-1-heptanone
• Synonyms: 1-(4-bromo-3-methylphenyl)-7-chloro-1-oxoheptane
• Molecular Formula: C₁₄H₁₈BrClO
• Molecular Weight: 317.65
• CAS Registry Number: 898760-98-0
• SMILES: Cc1cc(ccc1Br)C(=O)CCCCCCCl
• InChI: 1S/C14H18BrClO/c1-11-10-12(7-8-13(11)15)14(17)6-4-2-3-5-9-16/h7-8,10H,2-6,9H2,1H3
• InChIKey: IWCLULULOUMDNH-UHFFFAOYSA-N

Properties

• Density: 1.284g/cm³ (Cal.)
• Boiling point: 410.013°C at 760 mmHg (Cal.)
• Flash point: 201.769°C (Cal.)
• Refractive index: 1.533 (Cal.)