Chemical Properties of 6H-Purin-6-one, 1,7-dihydro-1-methyl- (CAS 1125-39-9)

6H-Purin-6-one, 1,7-dihydro-1-methyl-

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InChI
InChI=1S/C6H6N4O/c1-10-3-9-5-4(6(10)11)7-2-8-5/h2-3H,1H3,(H,7,8)
InChI Key
KIQMCGMHGVXDFW-UHFFFAOYSA-N
Formula
C6H6N4O
SMILES
Cn1cnc2[nH]cnc2c1=O
Molecular Weight1
150.14
CAS
1125-39-9
Other Names
  • Hypoxanthine, 1-methyl-
  • 1-Methylhypoxanthine
  • Purin-6(1H)-one, 1-methyl
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Physical Properties

Property Value Unit Source
log10WS -2.74 Crippen Calculated Property
logPoct/wat -0.825 Crippen Calculated Property
McVol 102.270 ml/mol McGowan Calculated Property
Inp 1969.00 NIST

Similar Compounds

Hypoxanthine, 1-butyl-. 1H-Purine-2,6-dione, 3,7-dihydro-1-methyl-. 7-Methylguanine. Theophylline. 1-Methyl-9-[(1e)-1-propenyl]-1,9-dihydro-6h-purin-6-one. Theobromine. 2,6-Dihydroxy-7-methylpurine. Purine-6(1h)-one, 1-benzyl-. caffeine. Uric acid, 1-methyl. 1-methyluric acid. 9H-purin-6(1h)-one, 9-ethyl-. 9H-purine-6(1h)-one, 9-benzyl-. Guanine, 1,9-dimethyl-. Hypoxanthine-9-acetic acid, ethyl ester.

Find more compounds similar to 6H-Purin-6-one, 1,7-dihydro-1-methyl-.

Sources

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