Methyl (3aR,6aS)-3A,4,5,6-Tetrahydropyrrolo[3,4-c]Pyrazole-6A(3H)-Carboxylate
[CAS# 446875-99-6]

Identification

• Name: Methyl (3aR,6aS)-3A,4,5,6-Tetrahydropyrrolo[3,4-c]Pyrazole-6A(3H)-Carboxylate
• Synonyms: (3aR,6aS)-methyl 3,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-6a-carboxylate
• Molecular Formula: C₇H₁₁N₃O₂
• Molecular Weight: 169.18
• CAS Registry Number: 446875-99-6
• SMILES: COC(=O)[C@@]12CNC[C@@H]1CN=N2
• InChI: 1S/C7H11N3O2/c1-12-6(11)7-4-8-2-5(7)3-9-10-7/h5,8H,2-4H2,1H3/t5-,7-/m1/s1
• InChIKey: OWNOTOZVCGKICH-IYSWYEEDSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Boiling point: 234.9±40.0°C at 760 mmHg (Cal.)
• Flash point: 95.8±27.3°C (Cal.)
• Refractive index: 1.673 (Cal.)