5743-12-4 Caffeine hydrous Caffeine hydrous

Synonyms： Caffeine monohydrate; Caffeine Hydrate; 1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione; 1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione hydrate (1:1)
CAS Number：5743-12-4
EINECS：200-362-1
Molecular Formula：C₈H₁₂N₄O₃
Molecular Weight：212.2059
InChI：InChI=1/C8H10N4O2.H2O/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2;/h4H,1-3H3;1H2
Molecular Structure：
Boiling point：416.8°C at 760 mmHg
Flash point：205.9°C
Vapour Pressur：3.72E-07mmHg at 25°C
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