Chemical Properties of Coprostan-3-ol, tert-butyldimethylsilyl ether (CAS 86679-45-0)

Coprostan-3-ol, tert-butyldimethylsilyl ether

InChI
InChI=1S/C33H62OSi/c1-23(2)12-11-13-24(3)28-16-17-29-27-15-14-25-22-26(34-35(9,10)31(4,5)6)18-20-32(25,7)30(27)19-21-33(28,29)8/h23-30H,11-22H2,1-10H3/t24-,25-,26-,27+,28-,29+,30+,32+,33-/m0/s1
InChI Key
MTTUKKKFWZKHGA-QFFWKFCOSA-N
Formula
C33H62OSi
SMILES
CC(C)CCCC(C)C1CCC2C3CCC4CC(O[Si](C)(C)C(C)(C)C)CCC4(C)C3CCC12C
Molecular Weight1
502.93
CAS
86679-45-0
Other Names
  • 5«beta»-Cholestan-3«alpha»-ol, tert-butyldimethylsilyl ether
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Physical Properties

Property Value Unit Source
Δvap 122.79 kJ/mol Relay (1.0) Calculated Property
log10WS -8.90 Relay (1.0) Calculated Property
logPoct/wat 10.498 Crippen Calculated Property
Inp 3298.20 NIST
Tboil 710.38 K Relay (1.0) Calculated Property
Tfus 368.73 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation 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

5«beta»-Pregnane-3«alpha»,20«alpha»-diol, (3-O)-TBDMSi, (20-O)-TMSi. 5«beta»-Pregnan-3«alpha»,20«beta»-diol, TBDMS. 5«beta»-Pregnane-3«alpha»,20«alpha»-diol, (3-O)-TMSi, (20-O)-TBDMSi. 5«alpha»-Pregnan-3«beta»,20«alpha»-diol, TBDMS. Silane, [[(3«alpha»,5«beta»,20R)-pregnane-3,20-diyl]bis(oxy)]bis[(1,1-dimethylethyl)dimethyl-. 5«alpha»-Pregnan-3«beta»,20«beta»-diol, TBDMS. 5«alpha»-Androstan-3«beta»,17«beta»-diol, TBDMS. Silane, [[(3«alpha»,5«alpha»,17«beta»)-androstane-3,17-diyl]bis(oxy)]bis[(1,1-dimethylethyl)dimethyl-. Silane, [[(3«alpha»,5«beta»,17«beta»)-androstane-3,17-diyl]bis(oxy)]bis[(1,1-dimethylethyl)dimethyl-. 5«alpha»-Androstan-3«alpha»,17«beta»-diol, TBDMS. Silane, [[(3«beta»,5«alpha»,17«beta»)-androstane-3,17-diyl]bis(oxy)]bis[(1,1-dimethylethyl)dimethyl-. Borneol, tert-butyldimethylsilyl ether. 3,3,5-Trimethylcyclohexan-1-ol, tert-butyldimethylsilyl ether. Androstan-17-one, 3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, (3«alpha»,5«alpha»)-. trans-Androsterone, tert-butyldimethylsilyl ether.

Find more compounds similar to Coprostan-3-ol, tert-butyldimethylsilyl ether.

Sources

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