8-Methylthiocaffeine

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Names

[ CAS No. ]:
6287-54-3

[ Name ]:
8-Methylthiocaffeine

[Synonym ]:
1,3,7-trimethyl-8-methylsulfanyl-3,7-dihydro-purine-2,6-dione
1,3,7-Trimethyl-8-methylmercapto-3,7-dihydro-purin-2,6-dion
UNII-16OKE808X6
Caffeine,8-(methylthio)
8-Methylthiocaffeine

Chemical & Physical Properties

[ Density]:
1.47g/cm3

[ Boiling Point ]:
442.4ºC at 760 mmHg

[ Molecular Formula ]:
C9H12N4O2S

[ Molecular Weight ]:
240.28200

[ Flash Point ]:
221.3ºC

[ Exact Mass ]:
240.06800

[ PSA ]:
87.12000

[ Index of Refraction ]:
1.693

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Methyl mercaptan
  • 1H-Purine-2,6-dione,8-chloro-3,7-dihydro-1,3,7-trimethyl-
  • 1,3-dimethyl-8-sulfanylidene-7,9-dihydropurine-2,6-dione
  • methyl iodide
  • Dimethyl sulfate
  • diazomethane
  • 1H-Purine-2,6-dione,3,7,8,9-tetrahydro-8-thioxo-
  • 1H-Purine-2,6-dione,3,7,8,9-tetrahydro-3,7-dimethyl-8-thioxo-
  • 8-Mercaptocaffeine

DownStream

Related Compounds

  • 8-(3-hydroxypropylamino)-1,3,7-trimethylpurine-2,6-dione
  • (8-iodoquinolin-7-yl) N,N-diethylcarbamate
  • 8-Chloro-4-hydroxy-3-quinolinecarbohydrazide
  • 8-benzyl-7-phenyl-2,3-dihydro-pyrido[3,4-d]pyridazine-1,4-dione
  • 8-Fluoro-imidazo[1,2-a]pyridine-2-carboxylic acid ethyl ester
  • 8-Butyryl-3-(2-methyl-2-butenyl)-3,8-diazabicyclo(3.2.1)octane
  • methyl 4-(5-(N-cyclopropylsulfamoyl)furan-2-carboxamido)benzoate
  • (4-(2-Fluorophenyl)piperazin-1-yl)(2-(phenylamino)thiazol-4-yl)methanone
  • 2-Chloro-N-(4-(cyanomethoxy)phenyl)-4,5-difluorobenzamide
  • 2-(2-(1H-pyrrol-1-yl)thiazol-4-yl)-1-(4-(2-methoxyphenyl)piperazin-1-yl)ethanone
  • (3Z)-5-fluoro-3-[2-(3-methoxyphenyl)-2-oxoethylidene]-1,3-dihydro-2H-indol-2-one
  • (3Z)-5-fluoro-3-[2-(4-methoxyphenyl)-2-oxoethylidene]-1,3-dihydro-2H-indol-2-one
  • (3Z)-5-fluoro-3-[2-(4-fluoro-2-methoxyphenyl)-2-oxoethylidene]-1,3-dihydro-2H-indol-2-one
  • (3Z)-3-[2-(2-methoxyphenyl)-2-oxoethylidene]-5-methyl-1,3-dihydro-2H-indol-2-one
  • 5-(methylsulfamoyl)-N-[(pyridin-3-yl)methyl]furan-2-carboxamide
  • N-(1-cyanocycloheptyl)-2-{[(2,4-dimethylphenyl)methyl](methyl)amino}acetamide
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