7-(2-Methoxyphenyl)-7-oxoheptanenitrile
[CAS# 898786-54-4]

Identification

• Name: 7-(2-Methoxyphenyl)-7-oxoheptanenitrile
• Synonyms: 7-(2-methoxyphenyl)-7-oxoheptanenitrile
• Molecular Formula: C₁₄H₁₇NO₂
• Molecular Weight: 231.29
• CAS Registry Number: 898786-54-4
• SMILES: COc1ccccc1C(=O)CCCCCC#N
• InChI: 1S/C14H17NO2/c1-17-14-10-6-5-8-12(14)13(16)9-4-2-3-7-11-15/h5-6,8,10H,2-4,7,9H2,1H3
• InChIKey: PKKAIPOHAPNEDV-UHFFFAOYSA-N

Properties

• Density: 1.047g/cm³ (Cal.)
• Boiling point: 406.301°C at 760 mmHg (Cal.)
• Flash point: 177.703°C (Cal.)
• Refractive index: 1.509 (Cal.)