3-Hydroxy-3-(4-nitrophenyl)propanenitrile
[CAS# 71312-64-6]

Identification

• Name: 3-Hydroxy-3-(4-nitrophenyl)propanenitrile
• Synonyms: β-HYDROXY-4-NITROBENZENEPROPANENITRILE
• Molecular Formula: C₉H₈N₂O₃
• Molecular Weight: 192.17
• CAS Registry Number: 71312-64-6
• SMILES: [O-][N+](=O)c1ccc(cc1)C(O)CC#N
• InChI: 1S/C9H8N2O3/c10-6-5-9(12)7-1-3-8(4-2-7)11(13)14/h1-4,9,12H,5H2
• InChIKey: HJMGPNYFZRPELU-UHFFFAOYSA-N

Properties

• Density: 1.351g/cm³ (Cal.)
• Boiling point: 443.383°C at 760 mmHg (Cal.)
• Flash point: 221.95°C (Cal.)