Chemical Properties of tubercidin

tubercidin

InChI
InChI=1S/C11H14N4O4/c12-9-5-1-2-15(10(5)14-4-13-9)11-8(18)7(17)6(3-16)19-11/h1-2,4,6-8,11,16-18H,3H2,(H2,12,13,14)
InChI Key
HDZZVAMISRMYHH-UHFFFAOYSA-N
Formula
C11H14N4O4
SMILES
Nc1ncnc2c1ccn2C1OC(CO)C(O)C1O
Molecular Weight1
266.26
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Physical Properties

Property Value Unit Source
ω 0.9531 Relay (1.0) Calculated Property
ΔfG° -2.03 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -417.40 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 155.54 kJ/mol Relay (1.0) Calculated Property
IE 8.35 eV Relay (1.0) Calculated Property
log10WS [-1.95; -1.95]   Show Hide
log10WS -1.95 Aq. Solubility Prediction
log10WS -1.95 Estimated Solubility
logPoct/wat -1.375 Crippen Calculated Property
McVol 179.470 ml/mol McGowan Calculated Property
Pc 3149.33 kPa Relay (1.0-beta) Calculated Property
Tboil 714.32 K Relay (1.0) Calculated Property
Tc 1099.75 K Relay (1.0) Calculated Property
Tfus 467.72 K Relay (1.0) Calculated Property
Vc 0.680 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Adenosine, N-(trimethylsilyl)-2',3'-bis-O-(trimethylsilyl)-, 5'-[bis(trimethylsilyl) phosphate]. 5-methyluridine, TMS. Benzylmorphine. Nicocodine. Buprenorphine. Dihydroergokryptine. Crinan-11-ol, 1,2-didehydro-3-methoxy-, (3«beta»,5«alpha»,11R,13«beta»,19«alpha»)-. [2,2'-Bimorphinan]-3,3',6,6'-tetrol, 7,7',8,8'-tetradehydro-4,5:4',5'-diepoxy-17,17'-dimethyl-, (5«alpha»,6«alpha»)-(5'«alpha»,6'«alpha»)-. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form). Deserpidine. Paclitaxel. Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'«alpha»,10«alpha»)-. Ergotamine. Ergocristine.

Find more compounds similar to tubercidin.

Sources

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