4,5,6-Triethoxy-7-Nitrophthalide
[CAS# 4995-54-4]

Identification

• Name: 4,5,6-Triethoxy-7-Nitrophthalide
• Synonyms: 4,5,6-Triethoxy-7-Nitro-3H-Isobenzofuran-1-One; 4,5,6-Triethoxy-7-Nitrophthalide
• Molecular Formula: C₁₄H₁₇NO₇
• Molecular Weight: 311.29
• CAS Registry Number: 4995-54-4
• EINECS: 225-655-1
• SMILES: C(OC1=C([N+]([O-])=O)C2=C(C(=C1OCC)OCC)COC2=O)C
• InChI: 1S/C14H17NO7/c1-4-19-11-8-7-22-14(16)9(8)10(15(17)18)12(20-5-2)13(11)21-6-3/h4-7H2,1-3H3
• InChIKey: FTLVJOVZLDLKLZ-UHFFFAOYSA-N

Properties

• Density: 1.3g/cm³ (Cal.)
• Boiling point: 532.298°C at 760 mmHg (Cal.)
• Flash point: 239.393°C (Cal.)