2-[(3,4-dimethoxyphenyl)methyl]-3,3-dimethoxy-propanenitrile
[CAS# 7520-73-2]

Identification

• Name: 2-[(3,4-dimethoxyphenyl)methyl]-3,3-dimethoxy-propanenitrile
• Synonyms: b-(3,4-Dimethoxyphenyl)-a-cyanopropionaldehydedimethylacetal
• Molecular Formula: C₁₄H₁₉NO₄
• Molecular Weight: 265.30
• CAS Registry Number: 7520-73-2
• SMILES: COc1ccc(cc1OC)CC(C#N)C(OC)OC
• InChI: 1S/C14H19NO4/c1-16-12-6-5-10(8-13(12)17-2)7-11(9-15)14(18-3)19-4/h5-6,8,11,14H,7H2,1-4H3
• InChIKey: DTRLSIFVXVPVCT-UHFFFAOYSA-N

Properties

• Density: 1.091g/cm³ (Cal.)
• Boiling point: 413.443°C at 760 mmHg (Cal.)
• Flash point: 162.339°C (Cal.)