Chemical Properties of 3Beta-acetoxy-17beta-toluenesulfonoxy-5-androstene (CAS 1259-22-9)

3Beta-acetoxy-17beta-toluenesulfonoxy-5-androstene

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InChI
InChI=1S/C28H38O5S/c1-18-5-8-22(9-6-18)34(30,31)33-26-12-11-24-23-10-7-20-17-21(32-19(2)29)13-15-27(20,3)25(23)14-16-28(24,26)4/h5-9,21,23-26H,10-17H2,1-4H3
InChI Key
VHSUWQHYYVDVEW-UHFFFAOYSA-N
Formula
C28H38O5S
SMILES
CC(=O)OC1CCC2(C)C(=CCC3C2CCC2(C)C(OS(=O)(=O)c4ccc(C)cc4)CCC32)C1
Molecular Weight1
486.66
CAS
1259-22-9
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Physical Properties

Property Value Unit Source
ΔfG° -351.08 kJ/mol Joback Calculated Property
ΔfH°gas -950.39 kJ/mol Joback Calculated Property
ΔfusH° 50.77 kJ/mol Joback Calculated Property
ΔvapH° 109.30 kJ/mol Joback Calculated Property
log10WS -7.40 Crippen Calculated Property
logPoct/wat 5.963 Crippen Calculated Property
McVol 375.280 ml/mol McGowan Calculated Property
Pc 1323.28 kPa Joback Calculated Property
Tboil 1057.11 K Joback Calculated Property
Tc 1304.60 K Joback Calculated Property
Tfus 679.73 K Joback Calculated Property
Vc 1.431 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1407.93; 1615.85] J/mol×K [1057.11; 1304.60] Show Hide
Cp,gas 1407.93 J/mol×K 1057.11 Joback Calculated Property
Cp,gas 1439.04 J/mol×K 1098.36 Joback Calculated Property
Cp,gas 1471.07 J/mol×K 1139.61 Joback Calculated Property
Cp,gas 1504.40 J/mol×K 1180.86 Joback Calculated Property
Cp,gas 1539.39 J/mol×K 1222.10 Joback Calculated Property
Cp,gas 1576.42 J/mol×K 1263.35 Joback Calculated Property
Cp,gas 1615.85 J/mol×K 1304.60 Joback Calculated Property

Similar Compounds

Bicyclohexyl-1,1'-diol, , 2-(N,N-dimethylaminomethyl)-ferroceneboronate. azadirachtin. «delta»1-tetrahydrocannabinolic acid, phenyl-boronate. Morphinan, 7,8-didehydro-4,5-epoxy-17-methyl-3,6-bis[(trimethylsilyl)oxy]-, (5«alpha»,6«alpha»)-. Buprenorphine. Deserpidine. 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). Dihydroergokryptine. 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 3Beta-acetoxy-17beta-toluenesulfonoxy-5-androstene.

Sources

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