6-(2-Methoxyphenyl)-6-oxohexanenitrile
[CAS# 898786-52-2]

Identification

• Name: 6-(2-Methoxyphenyl)-6-oxohexanenitrile
• Synonyms: 6-(2-methoxyphenyl)-6-oxohexanenitrile
• Molecular Formula: C₁₃H₁₅NO₂
• Molecular Weight: 217.26
• CAS Registry Number: 898786-52-2
• SMILES: COc1ccccc1C(=O)CCCCC#N
• InChI: 1S/C13H15NO2/c1-16-13-9-5-4-7-11(13)12(15)8-3-2-6-10-14/h4-5,7,9H,2-3,6,8H2,1H3
• InChIKey: ZIFRJUWVDWIDDI-UHFFFAOYSA-N

Properties

• Density: 1.063g/cm³ (Cal.)
• Boiling point: 395.085°C at 760 mmHg (Cal.)
• Flash point: 172.835°C (Cal.)
• Refractive index: 1.512 (Cal.)