Chemical Properties of 3',5'-Diacetylthymidine (CAS 6979-97-1)

3',5'-Diacetylthymidine

InChI
InChI=1S/C14H18N2O7/c1-7-5-16(14(20)15-13(7)19)12-4-10(22-9(3)18)11(23-12)6-21-8(2)17/h5,10-12H,4,6H2,1-3H3,(H,15,19,20)
InChI Key
RGVBNBFNSBMXID-UHFFFAOYSA-N
Formula
C14H18N2O7
SMILES
CC(=O)OCC1OC(n2cc(C)c(=O)[nH]c2=O)CC1OC(C)=O
Molecular Weight1
326.30
CAS
6979-97-1
Other Names
  • Thymidine, 3',5'-diacetate
  • Thymidine, 3',5'-bis-O-acetyl
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Physical Properties

Property Value Unit Source
ω 0.7920 Relay (1.0) Calculated Property
ΔfG° -542.95 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -1158.21 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 130.84 kJ/mol Relay (1.0) Calculated Property
IE 8.42 eV Relay (1.0) Calculated Property
log10WS -0.75 Relay (1.0) Calculated Property
logPoct/wat -0.855 Crippen Calculated Property
McVol 225.950 ml/mol McGowan Calculated Property
Pc 2010.38 kPa Relay (1.0-beta) Calculated Property
Inp 2439.00 NIST
Tboil 643.14 K Relay (1.0) Calculated Property
Tc 898.63 K Relay (1.0) Calculated Property
Tfus 404.38 K Relay (1.0) Calculated Property
Vc 0.843 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

THYMIDINE, 3'-(O-TERT.-BUTYLDIMETHYLSILYL)-5'-ACETYL-. Thymidine, 3'-O-cyclotetramethylene-tertbutylsilyl, 5'-O-acetyl. Thymidine, 3'-O-cyclotetramethylene-isopropylsilyl, 5'-O-acetyl. Thymidine, 3'-O-acetyl, 5'-O-TBDMS. 3'-O-tert-butyldimethylsilyl-thymidine. Thymidine, 3'-O-TBDMS, 5'-O-TFA. Eburnamenine-14-carboxylic acid, 14,15-dihydro-14-hydroxy-, methyl ester, (3«alpha»,14«alpha»,16«alpha»)-. Ethylmorphine, trimethylsilyl ether. Paclitaxel. [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»)-. Dihydroergokryptine. 6-acetyl-3-propionyl-morphine. Ajmaline. Ergocristine. Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'«alpha»,10«alpha»)-.

Find more compounds similar to 3',5'-Diacetylthymidine.

Sources

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