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Caffeine Citrated [69-22-7]

 


Identification
Copyright
CAS # 69-22-7, Caffeine Citrated
Name
Caffeine Citrated
Synonyms
Citric Acid; 1,3,7-Trimethylpurine-2,6-Dione; Caffeine; Citric Acid; 1,2,3-Propanetricarboxylic Acid, 2-Hydroxy-, Mixt. With 3,7-Dihydro-1,3,7-Trimethyl-1H-Purine-2,6-Dione
Molecular Formula
C14H18N4O9
Molecular Weight 386.32
CAS Registry Number
69-22-7
SMILES
C2=NC1=C(C(N(C)C(N1C)=O)=O)[N]2C.C(C(CC(O)=O)(C(O)=O)O)C(O)=O
InChI
1S/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)
InChIKey RCQXSQPPHJPGOF-UHFFFAOYSA-N
down Properties
Boiling point 416.8°C at 760 mmHg (Cal.)  ref.
Flash point 205.9°C (Cal.)  ref.
down Safety Data
Safety Description Safety glasses.   ref.
Market Analysis Reports
 
List of Reports Available for Caffeine Citrated
 

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