Chemical Properties of Sarsasapogenin (CAS 126-19-2)

Sarsasapogenin

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InChI
InChI=1S/C27H44O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h16-24,28H,5-15H2,1-4H3/t16?,17?,18-,19+,20?,21?,22?,23?,24?,25?,26?,27?/m0/s1
InChI Key
GMBQZIIUCVWOCD-NCYQLCQRSA-N
Formula
C27H44O3
SMILES
CC1CCC2(OC1)OC1CC3C4CCC5CC(O)CCC5(C)C4CCC3(C)C1C2C
Molecular Weight1
416.64
CAS
126-19-2
Other Names
  • Spirostan-3-ol, (3«beta»,5«beta»,25S)-
  • 5«beta»-Spirostan-3«beta»-ol, (25S)-
  • Parigenin
  • (25S)-5«beta»-spirostan-3«beta»-ol
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Physical Properties

Property Value Unit Source
Δf 84.47 kJ/mol Joback Calculated Property
Δfgas -699.48 kJ/mol Joback Calculated Property
Δfus 47.37 kJ/mol Joback Calculated Property
Δvap 96.77 kJ/mol Joback Calculated Property
log10WS -6.59 Crippen Calculated Property
logPoct/wat 5.794 Crippen Calculated Property
McVol 343.740 ml/mol McGowan Calculated Property
Pc 1236.35 kPa Joback Calculated Property
Tboil 1006.27 K Joback Calculated Property
Tc 1247.23 K Joback Calculated Property
Tfus 637.27 K Joback Calculated Property
Vc 1.282 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1428.95; 1717.59] J/mol×K [1006.27; 1247.23] Show Hide
Cp,gas 1428.95 J/mol×K 1006.27 Joback Calculated Property
Cp,gas 1469.35 J/mol×K 1046.43 Joback Calculated Property
Cp,gas 1512.10 J/mol×K 1086.59 Joback Calculated Property
Cp,gas 1557.75 J/mol×K 1126.75 Joback Calculated Property
Cp,gas 1606.85 J/mol×K 1166.91 Joback Calculated Property
Cp,gas 1659.94 J/mol×K 1207.07 Joback Calculated Property
Cp,gas 1717.59 J/mol×K 1247.23 Joback Calculated Property

Similar Compounds

Neotigogenin. Tigogenin. Smilagenin. Gitogenin. 10-Hydroxy-6,10-epoxy-7(14)-isodaucane. Diosgenin. 3Alpha,5alpha-cycloandrostan-6beta-ol,17-ethylenedioxy. 5«beta»-Pregnan-3«alpha»,17«alpha»,20«beta»-triol, 17,20-acetonide. 12-ethoxy-8 «alpha»,12-epoxy-13,14,15,16-tertanorlabdane. Cryptofauronol. 4,7-Methanobenzofuran, 2,2'-oxybis[octahydro-7,8,8-trimethyl-, [2«alpha»(2'R*,3'aS*,4'R*,7'R*,7'aS*),3a«alpha»,4«alpha»,7«alpha»,7a«alpha»]-. 7,10-Epoxy-10-methoxysalvialane. 17-Ethylenedioxy-androst-5-en-3beta-ol. 3,20-Bisethylenedioxy-16alpha-hydroxymethyl-5-pregnene. 13-ethoxy-8 «alpha»,13-epoxy-14,15,16-trinorlabdane.

Find more compounds similar to Sarsasapogenin.

Sources

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