8-Methylthiocaffeine

Suppliers

Names

[ 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
4-(3-Bromo-2-fluorophenyl)-1,3-oxazolidin-2-one
2-Ethyl-2-methylpent-4-en-1-ol
1-(3,5-Difluoropyridin-4-yl)-2,2,2-trifluoroethan-1-ol
2-(1-Bromoethyl)-4-methyl-1,3-thiazole
2-(2,4-dichlorophenoxy)-N-(2-hydroxy-2-(thiophen-2-yl)-2-(thiophen-3-yl)ethyl)acetamide
3-(2-fluorophenyl)-N-[2-hydroxy-2-(thiophen-2-yl)-2-(thiophen-3-yl)ethyl]propanamide
N'-hydroxy-3-methoxybutanimidamide
N-(2-hydroxy-2-(thiophen-2-yl)-2-(thiophen-3-yl)ethyl)tetrahydrofuran-3-carboxamide
4-ethyl-N-(2-hydroxy-2-(thiophen-2-yl)-2-(thiophen-3-yl)ethyl)-2,3-dioxopiperazine-1-carboxamide
N-(2-hydroxy-2-(thiophen-2-yl)-2-(thiophen-3-yl)ethyl)methanesulfonamide