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5-amino-3-(2-propynylsulfanyl)[1,2,4]triazolo[4,3-a]pyrimidin-7(8H)-one

HCID 178577611
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Basic information

CAS
514793-40-9
Standard SMILES
C#CCSc1n[nH]c2nc(=O)cc(N)n12
InChIKey
UAXOIYXDVMODJY-UHFFFAOYSA-N
Molecular formula
C8H7N5OS
Average molar mass
221.24 g/mol

Names & identifiers

Preferred name
5-amino-3-(2-propynylsulfanyl)[1,2,4]triazolo[4,3-a]pyrimidin-7(8H)-one
English name
5-amino-3-(2-propynylsulfanyl)[1,2,4]triazolo[4,3-a]pyrimidin-7(8H)-one
Molecular formula
C8H7N5OS
Molecular weight
221.24

Names & synonyms

5-amino-3-(2-propynylsulfanyl)[1,2,4]triazolo[4,3-a]pyrimidin-7(8H)-one1,2,4-Triazolo[4,3-a]pyrimidin-7(1H)-one, 5-amino-3-(2-propyn-1-ylthio)-

Database identifiers

CAS
514793-40-9

Properties

Physicochemical properties

Boiling point
344.9 · 344.9±52.0 °C(Predicted)
Density
1.61 · 1.61±0.1 g/cm3(Predicted)
pka
1.48 · 1.48±0.20(Predicted)

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