Chemical Properties of 1H-purine-2,6-dione, 3,7-dihydro-1-methyl-3-(2-methylpropyl)- (CAS 28822-58-4)

1H-purine-2,6-dione, 3,7-dihydro-1-methyl-3-(2-methylpropyl)-

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InChI
InChI=1S/C10H14N4O2/c1-6(2)4-14-8-7(11-5-12-8)9(15)13(3)10(14)16/h5-6H,4H2,1-3H3,(H,11,12)
InChI Key
APIXJSLKIYYUKG-UHFFFAOYSA-N
Formula
C10H14N4O2
SMILES
CC(C)Cn1c2nc[nH]c2c(=O)n(C)c1=O
Molecular Weight1
222.24
CAS
28822-58-4
Other Names
  • 1-Methyl-3-isobutylxanthine
  • 3,7-dihydro-3-isobutyl-1-methyl-1H-purine-2,6-dione
  • 3-Isobutyl-1-methyl-3,7-dihydro-1H-purine-2,6-dione
  • 3-Isobutyl-1-methylxanthine
  • IBMX
  • IMX
  • Isobutylmethylxanthine
  • Methylisobutylxanthine
  • NSC 165960
  • SC 2964
  • Xanthine, 1-methyl-3-(2-methylpropyl)
  • Xanthine, 3-Isobutyl-1-methyl-
Sources

Physical Properties

Property Value Unit Source
logPoct/wat 0.08 Crippen Calculated Property

Similar Compounds

Paraxanthine, n-propyl derivative. Xanthine, 1-(5'-hydroxyhexyl)-3-methyl-7-propyl. Xanthine, 7-(5'-oxohexyl)-3-methyl-1-propyl. Xanthine, 1-(5'-hydroxyhexyl)-3-methyl-7-propyl, TMS. Pentifylline. 1-(6'-hydroxyhexyl)-3-methyl-7-propylxanthine, O-TFA. 1-(5'-hydroxyhexyl)-3,7-dimethylxanthine, O-TFA. Bufylline. 1H-purine-2,6-dione, 7-ethyl-3,7-dihydro-1,3-dimethyl-. Proxyphylline. 1,3-Dimethylxanthine. 1H-purine-2,6,8(3h)-trione, 7,9-dihydro-1,3-dimethyl-. Etofylline. Theophylline, 7-(2,3-dihydroxypropyl)-. threo-1-(4',5'-dihydroxyhexyl)-3,7-dimethylxanthine, O-TFA.

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