Chemical Properties of Ethanol, 2-[2-(9h-purin-6-ylamino)ethylthio]-

Ethanol, 2-[2-(9h-purin-6-ylamino)ethylthio]-

InChI
InChI=1S/C9H13N5OS/c15-2-4-16-3-1-10-8-7-9(12-5-11-7)14-6-13-8/h5-6,15H,1-4H2,(H2,10,11,12,13,14)
InChI Key
KZIWLQWHCOIOQO-UHFFFAOYSA-N
Formula
C9H13N5OS
SMILES
OCCSCCNc1ncnc2[nH]cnc12
Molecular Weight1
239.30
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Physical Properties

Property Value Unit Source
IE 8.74 eV Relay (1.0) Calculated Property
log10WS -2.33 Relay (1.0) Calculated Property
logPoct/wat 0.008 Crippen Calculated Property
McVol 170.870 ml/mol McGowan Calculated Property
Tfus 458.55 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

7-acetyl-9-curassavoylheliotridine. Cytidine, methyl-TMS derivative. 4',5'-Diiodofluorescein. 4-(ethylamino)-2-(3-methoxypropyl)-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide. 2'-Deoxyguanosine, N-trimethylsilyl-, tris(trimethylsilyl) ether. (2-Hydroxy-3-phenyl-1,2-dihydroquinoxalin-1-yl)phenyl(3-phenyl-1-benzyl-1,2-dihydroquinoxalin-2-yl)methane. Cytidine, etho-oxime-TMS derivative. guanosine, TMS. Cytidine, buto-oxime-TMS derivative. (1'S,3R,4a'S,5a'S,10a'S)-Methyl 1'-methyl-2-oxo-1',4a',5',5a',7',8',10',10a'-octahydrospiro[indoline-3,6'-pyrano[3,4-f]indolizine]-4'-carboxylate. 9H-purine-6(1h)-thione, 9-beta-d-ribofuranosyl-, 2',3'-diacetate, 5'-bis(3,5-dimethylphenyl)phosphate. cyclomegistine. Cytidine, metho-oxime-TMS derivative. Retroisosenine. inosine-5'-monophosphate, TMS.

Find more compounds similar to Ethanol, 2-[2-(9h-purin-6-ylamino)ethylthio]-.

Sources

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