5a-Amino-7-methyl-4,5,5a,8-tetrahydro-8aH-[1,2,5]oxadiazolo[3,4-e]indol-8a-ol 6-oxide
[CAS# 164355-82-2]

Identification

• Name: 5a-Amino-7-methyl-4,5,5a,8-tetrahydro-8aH-[1,2,5]oxadiazolo[3,4-e]indol-8a-ol 6-oxide
• Synonyms: 5a-amino-7-methyl-4,5,5a,8-tetrahydro-8aH-[1,2,5]oxadiazolo[3,4-e]indol-8a-ol 6-oxide; 5a-amino-8a-hydroxy-7-methyl-5,5a,8,8a-tetrahydro-4H-[1,2,5]oxadiazolo[3,4-e]indole 6-oxide
• Molecular Formula: C₉H₁₂N₄O₃
• Molecular Weight: 224.22
• CAS Registry Number: 164355-82-2
• SMILES: CC1=[N+](C2(CCC3=NON=C3C2(C1)O)N)[O-]
• InChI: 1S/C9H12N4O3/c1-5-4-8(14)7-6(11-16-12-7)2-3-9(8,10)13(5)15/h14H,2-4,10H2,1H3
• InChIKey: TZPMRHXGKBJIGV-UHFFFAOYSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Boiling point: 462.5±55.0°C at 760 mmHg (Cal.)
• Flash point: 233.5±31.5°C (Cal.)
• Refractive index: 1.661 (Cal.)