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2406-91-9 1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione 2-hydroxypropane-1,2,3-tricarboxylate (1:1)

Chemical Name 1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione 2-hydroxypropane-1,2,3-tricarboxylate (1:1)
Synonyms 1,3,7-Trimethyl-3,7-dihydro-1H-purine-2,6-dione 2-hydroxypropane-1,2,3-tricarboxylate (1:1);1H-purine-2,6-dione, 3,7-dihydro-1,3,7-trimethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1) (salt);CAFCIT;Caffeina citrate;Caffeine citrate (1:1);caffeine citrated;CAFFEINE, CITRATE (1:1);Caffeine, citrated [USAN];Citrated caffein;Citric acid, compd. with caffeine (1:1)
Molecular Formula C14H18N4O9
Molecular Weight 386.3141
InChl InChI=1/C8H10N4O2.C6H8O7/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2;7-3(8)1-6(13,5(11)12)2-4(9)10/h4H,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
CAS Registry Number 2406-91-9;69-22-7;8003-10-9
Molecular Structure 2406-91-9;69-22-7;8003-10-9  1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione 2-hydroxypropane-1,2,3-tricarboxylate (1:1)
Boiling Point 416.8°C at 760 mmHg
Flash Point 205.9°C
Vapour Pressur 3.72E-07mmHg at 25°C
MSDS Material Safety Data Sheet

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