Chemical Properties of 7,24(28)-Ergostadienol acetate

7,24(28)-Ergostadienol acetate

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InChI
InChI=1S/C30H48O2/c1-19(2)20(3)8-9-21(4)26-12-13-27-25-11-10-23-18-24(32-22(5)31)14-16-29(23,6)28(25)15-17-30(26,27)7/h11,19,21,23-24,26-28H,3,8-10,12-18H2,1-2,4-7H3/t21-,23?,24-,26?,27?,28?,29-,30+/m1/s1
InChI Key
MITHMFYJJFILDI-JOINPANLSA-N
Formula
C30H48O2
SMILES
C=C(CCC(C)C1CCC2C3=CCC4CC(OC(C)=O)CCC4(C)C3CCC21C)C(C)C
Molecular Weight1
440.70
Sources

Physical Properties

Property Value Unit Source
Δf 210.93 kJ/mol Joback Calculated Property
Δfgas -526.08 kJ/mol Joback Calculated Property
Δfus 40.10 kJ/mol Joback Calculated Property
Δvap 88.40 kJ/mol Joback Calculated Property
logPoct/wat 8.13 Crippen Calculated Property
Pc 900.72 kPa Joback Calculated Property
Tboil 996.69 K Joback Calculated Property
Tc 1229.29 K Joback Calculated Property
Tfus 556.82 K Joback Calculated Property
Vc 1.48 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1472.17 J/mol×K 996.69 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 2
-O- (nonring) 1
-CH3 6
=CH- (ring) 1
=CH2 1
=C< (ring) 1
-CH2- 2
=C< 1
>C< (ring) 2
>C=O (nonring) 1
>CH- (ring) 5
-CH2- (ring) 8

Similar Compounds

7,25-Sigmastadienol acetate. Chondrillasterol acetate. 22-Stigmastenol acetate. Cholest-7-en-3-ol, acetate, (3«beta»)-. Stigmast-7-en-3-ol, acetate, (3«beta»,5«alpha»)-. Spinasterol acetate. 27-Nor-7,22-ergostadienol (E) acetate. Ergosta-7,22-dien-3-ol, acetate, (3.beta.,5.alpha.)-. 23,24-Dimethyl-7,22-cholestadienol acetate. Peposterol (7,24-Stigmastadienol) acetate. 28-Isoavenasterol acetate. Avenasterol acetate. Citrostadienol acetate. 24-Ethyl-23-dehydrolophenol acetate. 24-Ethyl-25-dehydrolophenol acetate, 24-.beta..

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