7-Chloro-1-(3-fluoro-4-methylphenyl)-1-heptanone
[CAS# 898761-33-6]

Identification

• Name: 7-Chloro-1-(3-fluoro-4-methylphenyl)-1-heptanone
• Synonyms: 7-chloro-1-(3-fluoro-4-methylphenyl)-1-oxoheptane
• Molecular Formula: C₁₄H₁₈ClFO
• Molecular Weight: 256.74
• CAS Registry Number: 898761-33-6
• SMILES: Cc1ccc(cc1F)C(=O)CCCCCCCl
• InChI: 1S/C14H18ClFO/c1-11-7-8-12(10-13(11)16)14(17)6-4-2-3-5-9-15/h7-8,10H,2-6,9H2,1H3
• InChIKey: XMQIRTSXUDZEOE-UHFFFAOYSA-N

Properties

• Density: 1.091g/cm³ (Cal.)
• Boiling point: 361.639°C at 760 mmHg (Cal.)
• Flash point: 172.513°C (Cal.)
• Refractive index: 1.499 (Cal.)