Chemical Properties of allo-Cholanic acid, 3«alpha»,7«alpha»-dihydroxy, Me-TMS

allo-Cholanic acid, 3«alpha»,7«alpha»-dihydroxy, Me-TMS

InChI
InChI=1S/C31H58O4Si2/c1-21(11-14-28(32)33-4)24-12-13-25-29-26(16-18-31(24,25)3)30(2)17-15-23(34-36(5,6)7)19-22(30)20-27(29)35-37(8,9)10/h21-27,29H,11-20H2,1-10H3/t21-,22-,23-,24-,25+,26+,27-,29+,30+,31-/m0/s1
InChI Key
FUVKOFYYHKWFJK-HFLDKKAXSA-N
Formula
C31H58O4Si2
SMILES
COC(=O)CCC(C)C1CCC2C3C(O[Si](C)(C)C)CC4CC(O[Si](C)(C)C)CCC4(C)C3CCC12C
Molecular Weight1
550.96
Other Names
  • 3«alpha»,7«alpha»-Dihydroxy-5«alpha»-cholanic acid, methyl ester, TMS
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Physical Properties

Property Value Unit Source
log10WS -6.52 Relay (1.0) Calculated Property
logPoct/wat 8.285 Crippen Calculated Property
Inp [3210.00; 3210.00]   Show Hide
Inp 3210.00 NIST
Inp 3210.00 NIST
Inp 3210.00 NIST
I 3552.00 NIST
Tfus 392.83 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Isochenodeoxycholic acid, trimethylsilyl ether-methyl ester. allo-Cholanic acid, 3«beta»,7«beta»-dihydroxy, Me-TMS. allo-Cholanic acid, 3«alpha»,7«beta»-dihydroxy, Me-TMS. Ursodeoxycholic acid, trimethylsilyl ether-methyl ester. allo-Cholanic acid, 3«beta»,7«alpha»-dihydroxy, Me-TMS. 3«beta»,7«beta»-Dihydroxy-5«beta»-cholanoic acid, MeTMS. 3«beta»,7«alpha»-Dihydroxy-5«beta»-cholanoic acid, MeTMS. 5«beta»-cholanoate,3«alpha»,7«alpha»-dihydroxy, methyl ester-trimethylsilyl ether. Chenodeoxycholic acid, trimethylsilyl ether-methyl ester. Cholanoic acid, 3,7-dihydroxy, methyl ester, TMS. 3«alpha»,7«beta»-Dihydroxy-5«beta»-homocholanoic acid, MeTMS. Homochenodeoxycholic acid, trimethylsilyl ether-methyl ester. allo-Cholanic acid, 7«alpha»-hydroxy, Me-TMS. allo-Cholanic acid, 7«beta»-hydroxy, Me-TMS. Cholanic acid, 7«alpha»-hydroxy, Me-TMS.

Find more compounds similar to allo-Cholanic acid, 3«alpha»,7«alpha»-dihydroxy, Me-TMS.

Sources

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