Chemical Properties of Ethanethiol, 2-(purin-8-yl)-

Ethanethiol, 2-(purin-8-yl)-

InChI
InChI=1S/C7H8N4S/c12-2-1-6-10-5-3-8-4-9-7(5)11-6/h3-4,12H,1-2H2,(H,8,9,10,11)
InChI Key
SRFSTFUZPMXDOF-UHFFFAOYSA-N
Formula
C7H8N4S
SMILES
SCCc1nc2ncncc2[nH]1
Molecular Weight1
180.23
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Physical Properties

Property Value Unit Source
ω 0.5748 Relay (1.0) Calculated Property
ΔfG° 324.22 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 235.60 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 93.87 kJ/mol Relay (1.0) Calculated Property
IE 9.34 eV Relay (1.0) Calculated Property
log10WS -1.45 Relay (1.0) Calculated Property
logPoct/wat 0.343 Crippen Calculated Property
McVol 126.840 ml/mol McGowan Calculated Property
Pc 5547.83 kPa Relay (1.0-beta) Calculated Property
Tboil 627.02 K Relay (1.0) Calculated Property
Tc 950.12 K Relay (1.0) Calculated Property
Tfus 461.84 K Relay (1.0) Calculated Property
Vc 0.462 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Purine-8-propanoic acid, 6-hydroxy, TMS. Hypoxanthine, 7-butyl-. 2'-Deoxyinosine, tris(trimethylsilyl) derivative. 1-Methylhypoxanthine riboside, TMS. 2'-Deoxyadenosine, 3',5'-bis(O-TMSi). 2'-Deoxyadenosine, bis(trimethylsilyl) deriv.. 1,3,5(10)-Oestratriene-3,17«beta»-diol, 3-TBDMS-17-HFB. 1-Tetrahydrocannabinol, 7-hydroxy, allyl-DMS. 3«beta»-hydroxyoroboidine. cytidine, TMS. 9H-purine, 6-amino-2-(methylamino)-9-beta-d-ribofuranosyl-. 2'-Deoxyadenosine, 3',5'-bis-O-TBDMS. 2'-Deoxyadenosine, 3'-O-TBDMS, 5'-O-TMS. 2'-Deoxyadenosine, 3'-O-TMS, 5'-O-TBDMS. Adenosine, 2'-deoxy-N-(trimethylsilyl)-3'-O-(trimethylsilyl)-, 5'-[bis(trimethylsilyl) phosphate].

Find more compounds similar to Ethanethiol, 2-(purin-8-yl)-.

Sources

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