56223-58-6

56223-58-6 structure
56223-58-6 structure

Name 1,3,7-trimethyl-8-sulfanylidene-7,9-dihydropurin-7-ium-2,6-dione,chloride
Synonyms 1,3,7-trimethyl-8-sulfanylidene-7,9-dihydropurin-7-ium-2,6-dione chloride
8-Mercaptocaffeine hydrochloride
CAFFEINE,8-MERCAPTO-,HYDROCHLORIDE
1H-Purine-2,6-dione,3,7-dihydro-8-mercapto-1,3,7-trimethyl-,monohydrochloride
Boiling Point 300.6ºC at 760 mmHg
Molecular Formula C8H11ClN4O2S
Molecular Weight 262.71700
Flash Point 135.6ºC
Exact Mass 262.02900
PSA 100.62000
LogP 0.06140