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Structure

5,7-Dimethyl-[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol

CAS
41266-80-2
Catalog Number
ACM41266802
Category
Other Products
Molecular Weight
180.23
Molecular Formula
C7H8N4S

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Specification

Synonyms
5,7-dimethyl[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol, 5,7-Dimethyl-[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol, 5,7-Dimethyl-2H-[1,2,4]triazolo[4,3-a]pyrimidine-3-thione, 5,7-dimethyl[1,2,4]triazolo[4,3-a]pyrimidine-3(2H)-thione, 41266-80-2, 5,7-dimethyl-4-hydro-1,2,4-triazolo[4,3-a]pyrimidine-3-thiol, SMR000009103, AC1LE2QG, AC1Q2IFM, AC1Q7F2I, MLS000071546, STOCK1S-63520, CTK4I4534, MolPort-000-248-431, MolPort-001-937-730, BB_SC-5678, HMS2274E20, KUC104401N, ALBB-007353, AR-1G6354
IUPAC Name
5,7-dimethyl-2H-[1,2,4]triazolo[4,3-a]pyrimidine-3-thione
Canonical SMILES
CC1=CC(=NC2=NNC(=S)N12)C
InChI Key
YINCJELKAOSUAF-UHFFFAOYSA-N
Boiling Point
259.6ºC at 760 mmHg
Flash Point
110.8ºC
Density
1.5g/cm³
Exact Mass
180.04700
H-Bond Acceptor
2
H-Bond Donor
1

Upstream Synthesis Route 1

  • 75-15-0
  • 23906-13-0
  • 41266-80-2

Reference: [1]Bollettino Chimico Farmaceutico,1998,vol. 137,p. 110 - 114

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