Methyl 5-Nitro-1,3-Benzoxazole-2-Carboxylate
[CAS# 49559-61-7]

Identification

• Name: Methyl 5-Nitro-1,3-Benzoxazole-2-Carboxylate
• Synonyms: 2-Benzoxazolecarboxylic acid, 5-nitro-, methyl ester; 5-Nitro-1,3-benzoxazole-2-carboxylate de méthyle; Methyl 5-nitro-1,3-benzoxazole-2-carboxylate
• Molecular Formula: C₉H₆N₂O₅
• Molecular Weight: 222.15
• CAS Registry Number: 49559-61-7
• SMILES: COC(=O)c1nc2cc(ccc2o1)[N+](=O)[O-]
• InChI: 1S/C9H6N2O5/c1-15-9(12)8-10-6-4-5(11(13)14)2-3-7(6)16-8/h2-4H,1H3
• InChIKey: ONAUIWQEAZPQEI-UHFFFAOYSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Boiling point: 366.8±34.0°C at 760 mmHg (Cal.)
• Flash point: 175.6±25.7°C (Cal.)