2-(4-Nitrophenyl)-1,3-propanediol
[CAS# 91748-03-7]

Identification

• Name: 2-(4-Nitrophenyl)-1,3-propanediol
• Synonyms: 2-(4-Nitrophenyl)-1,3-propanediol #; 2-(4-nitrophenyl)propane-1,3-diol
• Molecular Formula: C₉H₁₁NO₄
• Molecular Weight: 197.19
• CAS Registry Number: 91748-03-7
• SMILES: [O-][N+](=O)c1ccc(cc1)C(CO)CO
• InChI: 1S/C9H11NO4/c11-5-8(6-12)7-1-3-9(4-2-7)10(13)14/h1-4,8,11-12H,5-6H2
• InChIKey: LWDKPEXFAQGVTE-UHFFFAOYSA-N

Properties

• Density: 1.347g/cm³ (Cal.)
• Boiling point: 404.338°C at 760 mmHg (Cal.)
• Flash point: 179.611°C (Cal.)