6-Nitro-2-(Trichloromethyl)-2,3-Dihydroimidazo[2,1-b][1,3]Oxazole
[CAS# 127692-18-6]

Identification

• Name: 6-Nitro-2-(Trichloromethyl)-2,3-Dihydroimidazo[2,1-b][1,3]Oxazole
• Synonyms: 6-Nitro-2-(Trichloromethyl)-2,3-Dihydroimidazo[2,1-B]Oxazole; Aids-059079; Aids059079
• Molecular Formula: C₆H₄Cl₃N₃O₃
• Molecular Weight: 272.47
• CAS Registry Number: 127692-18-6
• SMILES: C1=C(N=C2OC(C(Cl)(Cl)Cl)C[N]12)[N+]([O-])=O
• InChI: 1S/C6H4Cl3N3O3/c7-6(8,9)3-1-11-2-4(12(13)14)10-5(11)15-3/h2-3H,1H2
• InChIKey: LTYSCKJWPQRRIR-UHFFFAOYSA-N

Properties

• Density: 2.051g/cm³ (Cal.)
• Boiling point: 424.003°C at 760 mmHg (Cal.)
• Flash point: 210.23°C (Cal.)

References

• (1): Philip Prathipati, Ngai Ling Ma* and Thomas H. Keller. Global Bayesian Models for the Prioritization of Antitubercular Agents, J. Chem. Inf. Model., 2008, 48 (12), pp 2362–2370