(3aS,6R)-6-Isopropyl-3A,4-Dihydro-3H-[1,3]Oxazolo[3,4-c][1,2,3]Triazole
[CAS# 111209-54-2]

Identification

• Name: (3aS,6R)-6-Isopropyl-3A,4-Dihydro-3H-[1,3]Oxazolo[3,4-c][1,2,3]Triazole
• Synonyms: (3aS,6R)-6-isopropyl-3,3a,4,6-tetrahydrooxazolo[3,4-c][1,2,3]triazole
• Molecular Formula: C₇H₁₃N₃O
• Molecular Weight: 155.20
• CAS Registry Number: 111209-54-2
• SMILES: CC(C)[C@@H]1N2[C@@H](CN=N2)CO1
• InChI: 1S/C7H13N3O/c1-5(2)7-10-6(4-11-7)3-8-9-10/h5-7H,3-4H2,1-2H3/t6-,7+/m0/s1
• InChIKey: MFRFALLNDACOHJ-NKWVEPMBSA-N

Properties

• Density: 1.373g/cm³ (Cal.)
• Boiling point: 212.915°C at 760 mmHg (Cal.)
• Flash point: 82.568°C (Cal.)
• Refractive index: 1.641 (Cal.)