6-Chloro-1-(3-Cyanophenyl)-1-Oxohexane
[CAS# 898786-74-8]

Identification

• Name: 6-Chloro-1-(3-Cyanophenyl)-1-Oxohexane
• Synonyms: 6-chloro-1-(3-cyanophenyl)-1-oxohexane
• Molecular Formula: C₁₃H₁₄ClNO
• Molecular Weight: 235.71
• CAS Registry Number: 898786-74-8
• SMILES: N#Cc1cccc(c1)C(=O)CCCCCCl
• InChI: 1S/C13H14ClNO/c14-8-3-1-2-7-13(16)12-6-4-5-11(9-12)10-15/h4-6,9H,1-3,7-8H2
• InChIKey: NGXQNSABIMWNEN-UHFFFAOYSA-N

Properties

• Density: 1.138g/cm³ (Cal.)
• Boiling point: 386.256°C at 760 mmHg (Cal.)
• Flash point: 187.401°C (Cal.)
• Refractive index: 1.53 (Cal.)