6-Nitro-4-Oxo-4H-1-Benzopyran-2-Carboxylic Acid Ethyl Ester
[CAS# 30095-79-5]

Identification

• Name: 6-Nitro-4-Oxo-4H-1-Benzopyran-2-Carboxylic Acid Ethyl Ester
• Synonyms: Ethyl 6-Nitro-4-Oxo-Chromene-2-Carboxylate; 6-Nitro-4-Oxo-2-Chromenecarboxylic Acid Ethyl Ester; 4-Keto-6-Nitro-Chromene-2-Carboxylic Acid Ethyl Ester
• Molecular Formula: C₁₂H₉NO₆
• Molecular Weight: 263.21
• CAS Registry Number: 30095-79-5
• EINECS: 250-047-8
• SMILES: C1=C(C=C2C(=C1)OC(=CC2=O)C(=O)OCC)[N+]([O-])=O
• InChI: 1S/C12H9NO6/c1-2-18-12(15)11-6-9(14)8-5-7(13(16)17)3-4-10(8)19-11/h3-6H,2H2,1H3
• InChIKey: RWGUGNHDBXRLSD-UHFFFAOYSA-N

Properties

• Density: 1.454g/cm³ (Cal.)
• Boiling point: 413.496°C at 760 mmHg (Cal.)
• Flash point: 191.226°C (Cal.)