5-Sulfanyl-1H-[1,2,3]Triazolo[4,5-d]Pyrimidin-7-Ol
[CAS# 134811-22-6]

Identification

• Name: 5-Sulfanyl-1H-[1,2,3]Triazolo[4,5-d]Pyrimidin-7-Ol
• Synonyms: 1,4,5,6-Tetrahydro-5-thioxo-7H-1,2,3-triazolo(4,5-d)pyrimidin-7-one; 1,4,5,6-tetrahydro-5-thioxo-7H-1,2,3-triazolo[4,5-d]pyrimidin-7-one; 1H-v-Triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione,5-thio- (8CI)
• Molecular Formula: C₄H₃N₅OS
• Molecular Weight: 169.16
• CAS Registry Number: 134811-22-6
• SMILES: C12=C(N=C(N=C1O)S)N=NN2
• InChI: 1S/C4H3N5OS/c10-3-1-2(8-9-7-1)5-4(11)6-3/h(H3,5,6,7,8,9,10,11)
• InChIKey: YLORBLDFYRRZLA-UHFFFAOYSA-N

Properties

• Density: 2.0±0.1g/cm³ (Cal.)
• Boiling point: 667.2±58.0°C at 760 mmHg (Cal.)
• Flash point: 357.3±32.3°C (Cal.)
• Refractive index: 1.934 (Cal.)