Chemical Properties of 9H-purine-6-thiol, 2-fluoro-9-beta-d-ribofuranosyl- (CAS 792-16-5)

9H-purine-6-thiol, 2-fluoro-9-beta-d-ribofuranosyl-

InChI
InChI=1S/C10H11FN4O4S/c11-10-13-7-4(8(20)14-10)12-2-15(7)9-6(18)5(17)3(1-16)19-9/h2-3,5-6,9,16-18H,1H2,(H,13,14,20)
InChI Key
MORQXRUBNWQJJH-UHFFFAOYSA-N
Formula
C10H11FN4O4S
SMILES
OCC1OC(n2cnc3c(S)nc(F)nc32)C(O)C1O
Molecular Weight1
302.28
CAS
792-16-5
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Physical Properties

Property Value Unit Source
ω 0.9086 Relay (1.0) Calculated Property
Δf -187.31 kJ/mol Relay (1.0-beta) Calculated Property
Δfgas -561.60 kJ/mol Relay (1.0) Calculated Property
Δvap 158.80 kJ/mol Relay (1.0) Calculated Property
IE 8.77 eV Relay (1.0) Calculated Property
log10WS -2.54 Relay (1.0) Calculated Property
logPoct/wat -1.134 Crippen Calculated Property
McVol 183.500 ml/mol McGowan Calculated Property
Pc 3048.92 kPa Relay (1.0-beta) Calculated Property
Tboil 699.11 K Relay (1.0) Calculated Property
Tc 1084.78 K Relay (1.0) Calculated Property
Tfus 481.38 K Relay (1.0) Calculated Property
Vc 0.688 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Inosine, tetramethyl ether. 2-Propanone, [(9-beta-d-ribofuranosyl-9h-purin-6-yl)thio]-. 9H-purine, 6-chloro-9-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-. 9H-purine, 6-chloro-9-(beta-d-ribofuranosyl)-. 9H-purine, 2-amino-9-beta-d-ribofuranosyl-. 9H-purine, 2-chloro-9-(beta-d-ribofuranosyl)-. N6-TFA-2'-Deoxyadenosine, 3'-O-TBDMS, 5'-O-TFA. N6-TFA-2'-Deoxyadenosine, 3'-O-TFA, 5'-O-TBDMS. 9H-purine, 6-ethyl-9-(beta-d-ribofuranosyl)-. Adenosine, 2',3'-O-(1-methylethylidene)-. Guanosine. Adenosine, 2-azido-. Adenosine, 2-methoxy-. 9H-purine, 2,6-dichloro-9-beta-d-ribofuranosyl-, 2',3',5'-triacetate. Adenosine.

Find more compounds similar to 9H-purine-6-thiol, 2-fluoro-9-beta-d-ribofuranosyl-.

Sources

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