Chemical Properties of 24-Ethyl-25-dehydrolophenol acetate, 24-.beta.

24-Ethyl-25-dehydrolophenol acetate, 24-.beta.

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InChI
InChI=1S/C32H52O2/c1-9-24(20(2)3)11-10-21(4)26-14-15-28-25-12-13-27-22(5)30(34-23(6)33)17-19-32(27,8)29(25)16-18-31(26,28)7/h12,21-22,24,26-30H,2,9-11,13-19H2,1,3-8H3/t21?,22-,24+,26?,27-,28?,29?,30?,31?,32?/m1/s1
InChI Key
UACMKUJYWHZEHR-GBSVDFTQSA-N
Formula
C32H52O2
SMILES
C=C(C)C(CC)CCC(C)C1CCC2C3=CCC4C(C)C(OC(C)=O)CCC4(C)C3CCC21C
Molecular Weight1
468.75
Sources

Physical Properties

Property Value Unit Source
Δf 220.06 kJ/mol Joback Calculated Property
Δfgas -587.70 kJ/mol Joback Calculated Property
Δfus 46.35 kJ/mol Joback Calculated Property
Δvap 92.54 kJ/mol Joback Calculated Property
logPoct/wat 8.76 Crippen Calculated Property
Pc 790.37 kPa Joback Calculated Property
Tboil 1037.78 K Joback Calculated Property
Tc 1273.34 K Joback Calculated Property
Tfus 575.12 K Joback Calculated Property
Vc 1.59 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1619.08 J/mol×K 1037.78 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 2
-O- (nonring) 1
=C< 1
=CH- (ring) 1
=CH2 1
=C< (ring) 1
-CH2- 3
>C< (ring) 2
>C=O (nonring) 1
-CH3 7
>CH- (ring) 6
-CH2- (ring) 7

Similar Compounds

Ergosta-7,24(28)-dien-3-ol, 4-methyl-, acetate, (3«beta»,4«alpha»)-. Citrostadienol acetate. 24-Ethyllophenol acetate, 24-«alpha». 28-Isocitrostadienol acetate. 24-Ethyl-23-dehydrolophenol acetate. Lophenol acetate. 24-Ethyllophenol acetate, 24-«beta». 24-Methyl-23-dehydrolophenol acetate. 24-Methyllophenol acetate. 24-Ethyl-24(25)-dehydrolophenol acetate. Chondrillasterol acetate. Stigmast-7-en-3-ol, acetate, (3«beta»,5«alpha»)-. 22-Stigmastenol acetate. 7,25-Sigmastadienol acetate. 7,24(28)-Ergostadienol acetate.

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