3-Methyl-4-nitro-5-(3-nitro-2-phenylpropyl)-1,2-oxazole
[CAS# 929719-03-9]

Identification

• Name: 3-Methyl-4-nitro-5-(3-nitro-2-phenylpropyl)-1,2-oxazole
• Synonyms: 3-methyl-4-nitro-5-(3-nitro-2-phenylpropyl)isoxazole
• Molecular Formula: C₁₃H₁₃N₃O₅
• Molecular Weight: 291.26
• CAS Registry Number: 929719-03-9
• SMILES: Cc1c(c(on1)CC(C[N+](=O)[O-])c2ccccc2)[N+](=O)[O-]
• InChI: 1S/C13H13N3O5/c1-9-13(16(19)20)12(21-14-9)7-11(8-15(17)18)10-5-3-2-4-6-10/h2-6,11H,7-8H2,1H3
• InChIKey: ZBFPFKSVTUDBQP-UHFFFAOYSA-N

Properties

• Density: 1.341g/cm³ (Cal.)
• Boiling point: 444.526°C at 760 mmHg (Cal.)
• Flash point: 222.641°C (Cal.)
• Refractive index: 1.584 (Cal.)