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8-Ethyl-1,3-Dimethyl-1H-Purine-2,6(3H,7H)-Dione
[CAS# 5770-28-5]

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Identification
Name 8-Ethyl-1,3-Dimethyl-1H-Purine-2,6(3H,7H)-Dione
Synonyms 8-Ethyl-1,3-Dimethyl-7H-Purine-2,6-Quinone; 1H-Purine-2,6-Dione, 8-Ethyl-3,7-Dihydro-1,3-Dimethyl-; 8-Ethyltheophylline
Molecular Structure CAS#: 5770-28-5, 8-Ethyl-1,3-Dimethyl-1H-Purine-2,6(3H,7H)-Dione
Molecular Formula C9H12N4O2
Molecular Weight 208.22
CAS Registry Number 5770-28-5
SMILES C(C2=NC1=C(C(N(C)C(N1C)=O)=O)[NH]2)C
InChI 1S/C9H12N4O2/c1-4-5-10-6-7(11-5)12(2)9(15)13(3)8(6)14/h4H2,1-3H3,(H,10,11)
InChIKey KTJSVELYMZTQJB-UHFFFAOYSA-N
Properties
Density 1.337g/cm3 (Cal.)
Boiling point 461.498°C at 760 mmHg (Cal.)
Flash point 232.906°C (Cal.)
Market Analysis Reports
List of Reports Available for 8-Ethyl-1,3-Dimethyl-1H-Purine-2,6(3H,7H)-Dione
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