Chemical Properties of 3,16,20-Tris[(trimethylsilyl)oxy]-5.alpha-pregnane, (3«beta»,16«alpha»,20«alpha»)- (CAS 33287-36-4)

InChI

InChI=1S/C30H60O3Si3/c1-21(31-34(4,5)6)28-27(33-36(10,11)12)20-26-24-14-13-22-19-23(32-35(7,8)9)15-17-29(22,2)25(24)16-18-30(26,28)3/h21-28H,13-20H2,1-12H3

InChI Key

GKSDWCMXICLASA-UHFFFAOYSA-N

Formula

C30H60O3Si3

SMILES

CC(O[Si](C)(C)C)C1C(O[Si](C)(C)C)CC2C3CCC4CC(O[Si](C)(C)C)CCC4(C)C3CCC21C

Molecular Weight¹

553.05

CAS

33287-36-4

Other Names

Silane, (5«alpha»-pregnane-3«beta»,16«alpha»,20«alpha»-triyltrioxy)tris[trimethyl-
3,16,20-Tris[(trimethylsilyl)oxy]pregnane, (5«alpha»,3«beta»,16«alpha»,20«alpha»)-
5-«alpha»-Pregnan-3«beta»,16«alpha»,20«alpha»-triol, tris-TMS
5«alpha»-Pregnane-3«beta»,16«alpha»,20«alpha»-triol, (3TMS)
5«alpha»-Pregnane-3«beta», 16«alpha», 20«alpha»--triol, MO TMS
5-«alpha»-Pregnan-3-«beta»,16-«alpha»,20-«alpha»-triol, MeTMS

log₁₀WS : Log10 of Water solubility in mol/l.
logP_oct/wat : Octanol/Water partition coefficient.
I_np : Non-polar retention indices.
¹: Molecular weight from the IUPAC atomic weights tables.

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.

Please note that you need to enable javascript to get access to all the properties. Here is how to do it for Internet Explorer and for Firefox.

Physical Properties

Property	Value	Source
log₁₀WS	-2.02	Crippen Calculated Property
logP_oct/wat	8.935	Crippen Calculated Property
I_np	[3022.00; 3060.00]
I_np	3022.00	NIST
I_np	3060.00	NIST

Similar Compounds

Find more compounds similar to 3,16,20-Tris[(trimethylsilyl)oxy]-5.alpha-pregnane, (3«beta»,16«alpha»,20«alpha»)-.

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.