Chemical Properties of 3-Oxa-a-nor-5alpha-androstan-17-ol, acetate (CAS 1509-45-1)

3-Oxa-a-nor-5alpha-androstan-17-ol, acetate

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C19H30O3/c1-12(20)22-17-7-5-14-13-4-6-16-19(3,10-11-21-16)15(13)8-9-18(14,17)2/h13-17H,4-11H2,1-3H3
InChI Key
WGNHYETZCSPJTP-UHFFFAOYSA-N
Formula
C19H30O3
SMILES
CC(=O)OC1CCC2C3CCC4OCCC4(C)C3CCC12C
Molecular Weight1
306.44
CAS
1509-45-1
Sources

Physical Properties

Property Value Unit Source
Δf -50.45 kJ/mol Joback Calculated Property
Δfgas -576.27 kJ/mol Joback Calculated Property
Δfus 30.49 kJ/mol Joback Calculated Property
Δvap 68.67 kJ/mol Joback Calculated Property
logPoct/wat 3.95 Crippen Calculated Property
Pc 1744.82 kPa Joback Calculated Property
Tboil 767.87 K Joback Calculated Property
Tc 1002.91 K Joback Calculated Property
Tfus 495.38 K Joback Calculated Property
Vc 0.93 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 841.02 J/mol×K 767.87 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-O- (ring) 1
-CH3 3
>C< (ring) 2
>C=O (nonring) 1
>CH- (ring) 5
-CH2- (ring) 8

Similar Compounds

Androstan-17-ol, acetate, (5«alpha»,17«beta»)-. exo-Fenchyl acetate. «beta»-Fenchyl acetate, exo-. Fenchyl acetate. endo-Fenchyl acetate. «alpha»-Isofenchyl acetate. Longiborneol acetate. Acetic acid, 1,7,7-trimethyl-bicyclo[2.2.1]hept-2-yl ester. Longiborneol acetate. Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl, acetate. Copabornyl acetate. Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, acetate, (1S-endo)-. Juniperol acetate. Bornyl acetate. Isobornyl acetate.

Find more compounds similar to 3-Oxa-a-nor-5alpha-androstan-17-ol, acetate.

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.