Carbonic Acid 1-[2-Nitro-1-Methyl-1H-Imidazol-5-Yl]-1-Methylethyl Phenyl Ester
[CAS# 64323-88-2]

Identification

• Name: Carbonic Acid 1-[2-Nitro-1-Methyl-1H-Imidazol-5-Yl]-1-Methylethyl Phenyl Ester
• Synonyms: [1-Methyl-1-(3-Methyl-2-Nitro-Imidazol-4-Yl)Ethyl] Phenyl Carbonate; Carbonic Acid [1-Methyl-1-(3-Methyl-2-Nitro-4-Imidazolyl)Ethyl] Phenyl Ester; Carbonic Acid [1-Methyl-1-(3-Methyl-2-Nitro-Imidazol-4-Yl)Ethyl] Phenyl Ester
• Molecular Formula: C₁₄H₁₅N₃O₅
• Molecular Weight: 305.29
• CAS Registry Number: 64323-88-2
• SMILES: C1=C([N](C(=N1)[N+]([O-])=O)C)C(OC(OC2=CC=CC=C2)=O)(C)C
• InChI: 1S/C14H15N3O5/c1-14(2,11-9-15-12(16(11)3)17(19)20)22-13(18)21-10-7-5-4-6-8-10/h4-9H,1-3H3
• InChIKey: KUOKVKLNRUSHGT-UHFFFAOYSA-N

Properties

• Density: 1.3g/cm³ (Cal.)
• Boiling point: 501.159°C at 760 mmHg (Cal.)
• Flash point: 256.892°C (Cal.)