Chemical Properties of 1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3-dimethyl- (CAS 944-73-0)

1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3-dimethyl-

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InChI
InChI=1S/C7H8N4O3/c1-10-4-3(8-6(13)9-4)5(12)11(2)7(10)14/h1-2H3,(H2,8,9,13)
InChI Key
OTSBKHHWSQYEHK-UHFFFAOYSA-N
Formula
C7H8N4O3
SMILES
Cn1c(=O)c2[nH]c(=O)[nH]c2n(C)c1=O
Molecular Weight1
196.16
CAS
944-73-0
Other Names
  • Uric acid, 1,3-dimethyl-
  • Ba 2751
  • Oxytheophylline
  • 1,3-Dimethyluric acid
  • 7,9-dihydro-1,3-dimethyl-1H-purine-2,6,8(3H)-trione
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Physical Properties

Property Value Unit Source
log10WS -2.56 Crippen Calculated Property
logPoct/wat -2.710 Crippen Calculated Property
McVol 128.100 ml/mol McGowan Calculated Property
Inp [2052.00; 2052.00]   Show Hide
Inp 2052.00 NIST
Inp 2052.00 NIST

Similar Compounds

Uric acid, 3-methyl. 1,3,7-Trimethyluric acid. 1-methyluric acid. Uric acid, 1-methyl. Uric acid, 3,7-dimethyl. Uric acid, 1,7-dimethyl. 8-Chlorotheophylline. 1H-Purine-2,6-dione, 3,7-dihydro-8-(hydroxymethyl)-1,3-dimethyl-. Theophylline. 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-8-(phenylmethyl)-. 1H-Purine-2,6-dione, 3,7-dihydro-1-methyl-. 1H-Purine-2,6-dione, 3,7-dihydro-1-methyl-3-(2-methylpropyl)-. Theobromine. Zidovudine. Xanthine, 1-(5'-hydroxyhexyl)-3-methyl-7-propyl, TMS.

Find more compounds similar to 1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3-dimethyl-.

Sources

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