Chemical Properties of 24-Methyllophenol acetate

24-Methyllophenol acetate

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InChI
InChI=1S/C31H52O2/c1-19(2)20(3)9-10-21(4)25-13-14-27-24-11-12-26-22(5)29(33-23(6)32)16-18-31(26,8)28(24)15-17-30(25,27)7/h11,19-22,25-29H,9-10,12-18H2,1-8H3/t20?,21?,22-,25?,26-,27?,28?,29?,30?,31?/m1/s1
InChI Key
MPSMORKTRDBZSB-SZUPDOHLSA-N
Formula
C31H52O2
SMILES
CC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C(C)CCC(C)C(C)C)C3=CCC2C1C
Molecular Weight1
456.74
Sources

Physical Properties

Property Value Unit Source
Δf 129.91 kJ/mol Joback Calculated Property
Δfgas -687.98 kJ/mol Joback Calculated Property
Δfus 42.82 kJ/mol Joback Calculated Property
Δvap 90.52 kJ/mol Joback Calculated Property
logPoct/wat 8.45 Crippen Calculated Property
Pc 816.33 kPa Joback Calculated Property
Tboil 1017.90 K Joback Calculated Property
Tc 1250.63 K Joback Calculated Property
Tfus 564.57 K Joback Calculated Property
Vc 1.54 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1578.55 J/mol×K 1017.9 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
>CH- 3
-CH3 8
=CH- (ring) 1
=C< (ring) 1
-CH2- 2
>C< (ring) 2
>C=O (nonring) 1
>CH- (ring) 6
-CH2- (ring) 7

Similar Compounds

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