1,3,7-trimethyl-2,6-dioxo-8-thioxo-2,3,6,7,8,9-hexahydro-1H-purin-7-ium chloride (56223-58-6)

Identification
Name:	1,3,7-trimethyl-2,6-dioxo-8-thioxo-2,3,6,7,8,9-hexahydro-1H-purin-7-ium chloride
Synonyms:	8-Mercaptocaffeine hydrochloride;CAFFEINE, 8-MERCAPTO-, HYDROCHLORIDE;1H-Purine-2,6-dione, 3,7-dihydro-8-mercapto-1,3,7-trimethyl-, monohydrochloride;AC1MHV7W;LS-48592;1,3,7-trimethyl-8-sulfanylidene-7,9-dihydropurin-7-ium-2,6-dione chloride;56223-58-6
CAS:	56223-58-6
Molecular Formula:	C₈H₁₁ClN₄O₂S
Molecular Weight:	262.7165
InChI:	InChI=1/C8H10N4O2S.ClH/c1-10-4-5(9-7(10)15)11(2)8(14)12(3)6(4)13;/h1-3H3,(H,9,15);1H
Molecular Structure:
Properties
Flash Point:	135.6°C
Boiling Point:	300.6°C at 760 mmHg
Flash Point:	135.6°C
Safety Data

Other Product

8-[(3-aminopropyl)sulfanyl]-1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-ium chloride
8-[(2-hydroxyethyl)sulfanyl]-1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-ium chloride
Spiro[cyclohexane-1,4'(3'H)-[1H-7,9a]- methanocyclohepta[c]pyran]-2-carboxaldehyde,6-(acetyloxy)hexahydro-3,3,8'-trimethyl-1',9'- dioxo-,(1S,2R,4'aS,6S,7'R,8'S,9'aS)-
Spiro[2-cyclohexene-1,2'(1'H)-cyclopenta[de]naphthacene]-9'-carboxamide,7',7'a,8',11',11'a,12'-hexahydro-5',6',7'a,10',11'a,12'-hexahydroxy-3'-methoxy-2,6,6-trimethyl-7',8'-dioxo-,(1R,7'aR,11'aR,12'R)-rel-(-)-
Acetamide,N-[9-[[2-(acetyloxy)ethoxy]methyl]-7-(1-butoxyethyl)-6,7,8,9-tetrahydro-6-oxo-8-thioxo-1H-purin-2-yl]-
Spiro[cyclopropane-1,2'(1'H)-phenanthrene]-2-carboxaldehyde,3',4'b,5',6',8'a,9'-hexahydro-4',9'-dihydroxy-4'b,7',8'-trimethyl-1',3'-dioxo-,(1R,4'bS,8'aS,9'R)- (9CI)
Spiro[cyclohexane-1,4'(3'H)-[1H-7,9a]methanocyclohepta[c]pyran]-2-carboxaldehyde,6-(acetyloxy)hexahydro-5'-hydroxy-3,3,8'-trimethyl-1',9'-dioxo-,(1S,2R,4'aS,5'S,6S,7'S,8'R,9'aS)- (9CI)
Spiro[3H-indole-3,1'(5'H)-indolizin]-2(1H)-one,6'-ethyl-2',3',6',7',8',8'a-hexahydro-7'-(2-hydroxyethyl)-, (1'S,6'R,7'R,8'aS)-
Acetamide,N-[9-[[2-(acetyloxy)ethoxy]methyl]-6,7,8,9-tetrahydro-7-[(octyloxy)methyl]-6-oxo-8-thioxo-1H-purin-2-yl]-
Spiro[2-cyclohexene-1,2'(1'H)-cyclopenta[de]naphthacene]-9'-carboxamide,6'-(b-D-glucopyranosyloxy)-7',7'a,8',11',11'a,12'-hexahydro-5',7'a,10',11'a,12'-pentahydroxy-3'-methoxy-2,6,6-trimethyl-7',8'-dioxo-,[2'S-(2'a,7'ab,11'ab,12'b)]- (9CI)
Spiro[cyclohexane-1,4'(3'H)-[1H-7,9a]methanocyclohepta[c]pyran]-2-carboxaldehyde,6-(acetyloxy)-3-[(acetyloxy)methyl]hexahydro-5'-hydroxy-3-methyl-8'-methylene-1',9'-dioxo-,(1S,2R,3R,4'aS,5'R,6S,7'S,9'aS)-
Spiro[furan-2(3H),3'(1'H)-naphtho[1,2-c]furan]-1'-one,4,5,6',7',8',9'-hexahydro-4,6',6'-trimethyl- (9CI)
Spiro[furan-2(3H),3'(1'H)-naphtho[1,2-c]furan]-1'-one,4,5,6',7',8',9'-hexahydro-4,6',6'-trimethyl- (9CI)
Spiro[furan-2(3H),3'(1'H)-naphtho[1,2-c]furan]- 1'-one,4,5,6',7',8',9'-hexahydro-4,6',6'- trimethyl-,(2R,4S)-rel-
9-[3-hydroxy-1-(hydroxymethyl)propyl]-6-thioxo-6,9-dihydro-3H-purin-9-ium chloride
(1S,2R,4'aβ,6S,7'S,9a'S)-6-(Acetyloxy)-4'a,5',6',7',8',9'-hexahydro-5'α-hydroxy-3,3-dimethyl-8'-methylene-1',9'-dioxospiro[cyclohexane-1,4'(3'H)-[1H-7,9a]methanocyclohepta[c]pyran]-2-carbaldehyde
Spiro[cyclohexane-1,4'(3'H)-[1H-7,9a]methanocyclohepta[c]pyran]-2-carboxaldehyde,6-(acetyloxy)hexahydro-5'-hydroxy-3,3-dimethyl-8'-methylene-1',9'-dioxo-,(1S,2R,4'aS,5'R,6S,7'S,9'aS)-
Spiro[cyclohexane-1,4'(3'H)-[1H-7,9a]methanocyclohepta[c]pyran]-2-carboxaldehyde,6-(acetyloxy)hexahydro-5'-hydroxy-3,3-dimethyl-8'-methylene-1',9'-dioxo-,(1S,2R,4'aS,5'S,7'S,9'aS)-
Benzo[3,4]-18-norandrosta-3,12,15-trien-17- one,6'-ethyl-1',2',3',4',5',6'-hexahydro-7- hydroxy-4,6',8-trimethyl-,(3â,4R,6'R,7â,8R,9â,- 10R,14â)-
Borinic acid,1,2,3,4,8,9-hexahydro-6-hydroxy-1,3-dimethyl-2,4-dioxo-9-(phenylmethyl)-7-propylpyrimido[2,1-f]purin-8-ylester