7-(4-Methoxyphenyl)-7-oxoheptanenitrile
[CAS# 898786-66-8]

Identification

• Name: 7-(4-Methoxyphenyl)-7-oxoheptanenitrile
• Synonyms: 7-(4-methoxyphenyl)-7-oxoheptanenitrile
• Molecular Formula: C₁₄H₁₇NO₂
• Molecular Weight: 231.29
• CAS Registry Number: 898786-66-8
• SMILES: COc1ccc(cc1)C(=O)CCCCCC#N
• InChI: 1S/C14H17NO2/c1-17-13-9-7-12(8-10-13)14(16)6-4-2-3-5-11-15/h7-10H,2-6H2,1H3
• InChIKey: VQSYASVKMHAFAV-UHFFFAOYSA-N

Properties

• Density: 1.047g/cm³ (Cal.)
• Boiling point: 414.738°C at 760 mmHg (Cal.)
• Flash point: 181.339°C (Cal.)
• Refractive index: 1.509 (Cal.)