Chemical Properties of 5-Pregnene-3«beta»,20«alpha»,21-triol, triacetate

5-Pregnene-3«beta»,20«alpha»,21-triol, triacetate

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InChI
InChI=1S/C27H40O6/c1-16(28)31-15-25(33-18(3)30)24-9-8-22-21-7-6-19-14-20(32-17(2)29)10-12-26(19,4)23(21)11-13-27(22,24)5/h6,20-25H,7-15H2,1-5H3/t20-,21?,22?,23?,24+,25-,26-,27-/m1/s1
InChI Key
SZFAWVIPSFYGQF-OJOUBPFUSA-N
Formula
C27H40O6
SMILES
CC(=O)OCC(OC(C)=O)C1CCC2C3CC=C4CC(OC(C)=O)CCC4(C)C3CCC12C
Molecular Weight1
460.60
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Physical Properties

Property Value Unit Source
Δf -359.02 kJ/mol Joback Calculated Property
Δfgas -1064.12 kJ/mol Joback Calculated Property
Δfus 44.01 kJ/mol Joback Calculated Property
Δvap 101.01 kJ/mol Joback Calculated Property
log10WS -5.92 Crippen Calculated Property
logPoct/wat 4.992 Crippen Calculated Property
McVol 365.870 ml/mol McGowan Calculated Property
Pc 1105.94 kPa Joback Calculated Property
Inp [3230.00; 3230.00]   Show Hide
Inp 3230.00 NIST
Inp 3230.00 NIST
Tboil 1084.51 K Joback Calculated Property
Tc 1330.40 K Joback Calculated Property
Tfus 698.05 K Joback Calculated Property
Vc 1.381 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1428.63; 1650.39] J/mol×K [1084.51; 1330.40] Show Hide
Cp,gas 1428.63 J/mol×K 1084.51 Joback Calculated Property
Cp,gas 1461.35 J/mol×K 1125.49 Joback Calculated Property
Cp,gas 1495.29 J/mol×K 1166.47 Joback Calculated Property
Cp,gas 1530.81 J/mol×K 1207.46 Joback Calculated Property
Cp,gas 1568.27 J/mol×K 1248.44 Joback Calculated Property
Cp,gas 1608.01 J/mol×K 1289.42 Joback Calculated Property
Cp,gas 1650.39 J/mol×K 1330.40 Joback Calculated Property

Similar Compounds

5-Pregnene-3«beta»,20«beta»,21-triol, triacetate. Androst-5-ene-16beta-propionic acid,3beta,17beta-dihydroxy-, delta-lactone, acetate. 5-Pregnen-3-«beta»,20-«beta»-diol, TFA. 5-Pregnen-3-«beta»,20-«alpha»-diol, TFA. 5-Pregnen-3-«beta»,20-«alpha»-diol, HFB. 5-Pregnen-3-«beta»,20-«beta»-diol, HFB. 5,22,25-Stigmastatrienol acetate. 5-Pregnen-3beta-ol, 16alpha,17alpha-epoxy-20-ethylenedioxy-, acetate. 5-Androsten-3-«beta»,17-«beta»-diol, TFA. 5-Androsten-3-«beta»,17-«alpha»-diol, TFA. 5-Androsten-3-«alpha»,17-«beta»-diol, TFA. 20«beta»,21-Dihydroxypregn-4-en-3-one, 20,21-acetonide. 5-Androsten-3-«alpha»,17-«beta»-diol, HFB. 5-Androsten-3-«beta»,17-«alpha»-diol, HFB. 5-Androsten-3-«beta»,17-«beta»-diol, HFB.

Find more compounds similar to 5-Pregnene-3«beta»,20«alpha»,21-triol, triacetate.

Sources

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