5-Amino-1,3a,4,7a-tetrahydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
[CAS# 606490-07-7]

Identification

• Name: 5-Amino-1,3a,4,7a-tetrahydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
• Synonyms: 5-amino-3a,4-dihydro-1H-[1,2,3]triazolo[4,5-d]pyrimidin-7(7aH)-one
• Molecular Formula: C₄H₆N₆O
• Molecular Weight: 154.13
• CAS Registry Number: 606490-07-7
• SMILES: C12C(NC(=NC1=O)N)N=NN2
• InChI: 1S/C4H6N6O/c5-4-6-2-1(3(11)7-4)8-10-9-2/h1-2H,(H,8,9)(H3,5,6,7,11)
• InChIKey: JQEYKFMPCHACPK-UHFFFAOYSA-N

Properties

• Density: 2.683g/cm³ (Cal.)
• Boiling point: 351.689°C at 760 mmHg (Cal.)
• Flash point: 166.496°C (Cal.)
• Refractive index: 2.308 (Cal.)