Chemical Properties of Methyl 5-«beta»-cholan-12-«alpha»-ol-3-one-24-oate, oxime, TMS # 1

Methyl 5-«beta»-cholan-12-«alpha»-ol-3-one-24-oate, oxime, TMS # 1

InChI
InChI=1S/C31H57NO4Si2/c1-21(11-16-29(33)34-4)25-14-15-26-24-13-12-22-19-23(32-36-38(8,9)10)17-18-30(22,2)27(24)20-28(31(25,26)3)35-37(5,6)7/h21-22,24-28H,11-20H2,1-10H3/b32-23+/t21?,22-,24?,25?,26?,27?,28+,30?,31?/m0/s1
InChI Key
QIWSBVFPWMELCB-NAALBDNSSA-N
Formula
C31H57NO4Si2
SMILES
COC(=O)CCC(C)C1CCC2C3CCC4CC(=NO[Si](C)(C)C)CCC4(C)C3CC(O[Si](C)(C)C)C12C
Molecular Weight1
563.96
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
log10WS -6.44 Relay (1.0) Calculated Property
logPoct/wat 8.272 Crippen Calculated Property
Inp [3301.00; 3302.00]   Show Hide
Inp 3301.00 NIST
Inp 3302.00 NIST
Inp 3301.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, 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

Methyl 5-.beta.-cholan-12-.alpha.-ol-3-one-24-oate, oxime, TMS # 2. Methyl 5-«beta»-cholan-7-«alpha»-12-«alpha»-diol-3-one-24-oate, oxime, TMS. Methyl 5-.beta.-cholan-7-.alpha.-ol-3-one-24-oate, oxime, TMS # 1. Methyl 5-«beta»-cholan-7-«alpha»-ol-3-one-24-oate, oxime, TMS # 2. Methyl 5-«beta»-cholan-3-«alpha»,12-«alpha»-diol-7-one-24-oate, oxime, TMS. Methyl 5-«beta»-cholan-3-«alpha»-ol-12-one-24-oate, oxime, TMS. Methyl 5-«beta»-cholan-3-«beta»-ol-12-one-24-oate, oxime, TMS. Methyl 5-«beta»-cholan-3-«alpha»,7-«alpha»-diol-12-one-24-oate, oxime, TMS. Methyl 5-.beta.-cholan-3-.alpha.-ol-7-one-24-oate, oxime, TMS. Cholan-24-oic acid, 3,12-bis[(trimethylsilyl)oxy]-, methyl ester, (3«alpha»,5«beta»,12«alpha»)-. 5-«alpha»-Cholanoic acid, 3-«alpha»-12-«beta»-dihydroxy, methyl ester, TMS. Cholanic acid, 3«alpha»,12«alpha»-dihydroxy, Me-TMS. 3«alpha»,12«beta»-Dihydroxy-5«beta»-cholanoic acid, methyl ester-trimethylsilyl ether. 3-«beta»,12-«alpha»-Dihydroxy-5-«beta»-cholanoic acid, MeTMS. allo-Cholanic acid, 3«alpha»,12«alpha»-dihydroxy, Me-TMS.

Find more compounds similar to Methyl 5-«beta»-cholan-12-«alpha»-ol-3-one-24-oate, oxime, TMS # 1.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.