Chemical Properties of Adenine, 9-(3,5-o-isopropylidene-beta-d-xylofuranosyl)- (CAS 7687-49-2)

Adenine, 9-(3,5-o-isopropylidene-beta-d-xylofuranosyl)-

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InChI
InChI=1S/C13H17N5O4/c1-13(2)20-3-6-9(22-13)8(19)12(21-6)18-5-17-7-10(14)15-4-16-11(7)18/h4-6,8-9,12,19H,3H2,1-2H3,(H2,14,15,16)
InChI Key
XHZOUHXBGRSPRW-UHFFFAOYSA-N
Formula
C13H17N5O4
SMILES
CC1(C)OCC2OC(n3cnc4c(N)ncnc43)C(O)C2O1
Molecular Weight1
307.31
CAS
7687-49-2
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Physical Properties

Property Value Unit Source
ω 0.7868 Relay (... Calculated Property
ΔfG° 68.14 kJ/mol Relay (... Calculated Property ⚠️
ΔfH°gas -416.29 kJ/mol Relay (... Calculated Property
ΔvapH° 128.27 kJ/mol Relay (... Calculated Property
IE 8.42 eV Relay (... Calculated Property
log10WS -2.59 Relay (... Calculated Property
logPoct/wat -0.182 Crippen Calculated Property
McVol 206.770 ml/mol McGowan Calculated Property
Pc 1999.46 kPa Relay (... Calculated Property ⚠️
Tboil 695.31 K Relay (... Calculated Property
Tc 1042.93 K Relay (... Calculated Property
Tfus 470.35 K Relay (... Calculated Property
Vc 0.838 m3/kmol Relay (... Calculated Property

Similar Compounds

Adenosine, 2',3'-O-(1-methylethylidene)-. Inosine, tetramethyl ether. Adenosine 3',5'-cyclic monophosphate. Adenosine, 2-chloro-. 9H-purine, 6-amino-2-(methylamino)-9-beta-d-ribofuranosyl-. Adenosine, 2-methoxy-. Adenosine. 9H-purine, 6-chloro-9-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-. [2H5]trans-Zeatin riboside, permethylated. cis-Zeatin riboside, permethylated. 5'-Inosinic acid, dibutyl ester. 9H-purine-6(1h)-thione, 9-beta-d-ribofuranosyl-, 3',5'-cyclic phosphate. Guanosine. [(3S,4r,5s)-4-acetyloxy-5-(acetyloxymethyl)-2-(2,6-diaminopurin-9-yl)oxolan-3-yl] acetate. 9H-purine, 2,6-difluoro-9-beta-d-xylofuranosyl-, 2',3',5'-triacetate.

Find more compounds similar to Adenine, 9-(3,5-o-isopropylidene-beta-d-xylofuranosyl)-.

Sources

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