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)Cn1c(=O)n(C)c(=O)c2[nH]cnc21
Molecular Weight1
222.24
CAS
28822-58-4
Other Names
  • IBMX
  • IMX
  • Isobutylmethylxanthine
  • 3-Isobutyl-1-methylxanthine
  • Methylisobutylxanthine
  • 1-Methyl-3-isobutylxanthine
  • SC 2964
  • Xanthine, 3-Isobutyl-1-methyl-
  • 3-Isobutyl-1-methyl-3,7-dihydro-1H-purine-2,6-dione
  • Xanthine, 1-methyl-3-(2-methylpropyl)
  • NSC 165960
  • 3,7-dihydro-3-isobutyl-1-methyl-1H-purine-2,6-dione
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Physical Properties

Property Value Unit Source
log10WS -3.25 Crippen Calculated Property
logPoct/wat -0.403 Crippen Calculated Property
McVol 164.500 ml/mol McGowan Calculated Property
Inp [2150.00; 2150.00]   Show Hide
Inp 2150.00 NIST
Inp 2150.00 NIST
Inp 2150.00 NIST

Similar Compounds

Paraxanthine, n-propyl derivative. Xanthine, 7-(5'-oxohexyl)-3-methyl-1-propyl. Xanthine, 1-(5'-hydroxyhexyl)-3-methyl-7-propyl, TFA. Xanthine, 1-(5'-hydroxyhexyl)-3-methyl-7-propyl, TMS. Xanthine, 1-(5'-hydroxyhexyl)-3-methyl-7-propyl. Carteolol hydroxy, acetylated. Adenosine, 2'-deoxy-N-(trimethylsilyl)-3'-O-(trimethylsilyl)-, 5'-[bis(trimethylsilyl) phosphate]. 1-(6'-hydroxyhexyl)-3-methyl-7-propylxanthine, O-TFA. Adenosine, N-(trimethylsilyl)-2',3'-bis-O-(trimethylsilyl)-, 5'-[bis(trimethylsilyl) phosphate]. N6-(cyclotetramethylene-tertbutylsilyl)-2'-Deoxyadenosine, 3',5'-bis-O-TBDMS. Uridine, 2'-O-TBDMS, 3'-O-acetyl, 5'-O-TBDMS. Uridine, 2'-O-TBDMS, 3',5'-bis-O-acetyl. 2'-Deoxyadenosine, 3',5',N6-tris(O-TMTBSi). Uridine, 2',3'-bis-O-acetyl, 5'-O-TBDMS. Vobassan-17-oic acid, 4-demethyl-3-oxo-, methyl ester.

Find more compounds similar to 1H-Purine-2,6-dione, 3,7-dihydro-1-methyl-3-(2-methylpropyl)-.

Sources

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