Chemical Properties of 1H-Purine-2,6-dione, 3,7-dihydro-3,7-dimethyl- (CAS 83-67-0)

1H-Purine-2,6-dione, 3,7-dihydro-3,7-dimethyl-

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InChI
InChI=1S/C7H8N4O2/c1-10-3-8-5-4(10)6(12)9-7(13)11(5)2/h3H,1-2H3,(H,9,12,13)
InChI Key
YAPQBXQYLJRXSA-UHFFFAOYSA-N
Formula
C7H8N4O2
SMILES
Cn1cnc2c1c(=O)[nH]c(=O)n2C
Molecular Weight1
180.16
CAS
83-67-0
Other Names
  • 1H-Purine-2,6-dione, 3,7-dihydro-3,7-dimethyl-
  • 3,7-Dimethylxanthine
  • Diurobromine
  • NSC 5039
  • SC 15090
  • Santheose
  • Teobromin
  • Theosalvose
  • Theostene
  • Thesal
  • Thesodate
  • Xanthine, 3,7-dimethyl-
Sources

Physical Properties

Property Value Unit Source
logPoct/wat -1.04 Crippen Calculated Property

Similar Compounds

Uric acid, 3,7-dimethyl. Caffeine. 1,3,7-Trimethyluric acid. Uric acid, 3-methyl. 1H-purine-2,6-dione, 7-ethyl-3,7-dihydro-1,3-dimethyl-. Tetramethyluric acid. Etofylline. 1,3-Dimethylxanthine. Bufylline. Uric acid, 1,7-dimethyl. 1H-purine-2,6,8(3h)-trione, 7,9-dihydro-1,3-dimethyl-. Etamiphyllin. Caffeine, 8-chloro. Proxyphylline. Theophylline, 7-(2,3-dihydroxypropyl)-.

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