Chemical Properties of 28-Norhomohopan-31-oic acid methyl ester

28-Norhomohopan-31-oic acid methyl ester

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InChI
InChI=1S/C31H52O2/c1-20(19-27(32)33-7)21-9-10-23-22(21)13-17-30(5)24(23)11-12-26-29(4)16-8-15-28(2,3)25(29)14-18-31(26,30)6/h20-26H,8-19H2,1-7H3/t20?,21-,22+,23?,24?,25?,26?,29+,30-,31-/m0/s1
InChI Key
AYLCQMKAZURMNK-GLUWJVINSA-N
Formula
C31H52O2
SMILES
COC(=O)CC(C)C1CCC2C1CCC1(C)C2CCC2C3(C)CCCC(C)(C)C3CCC21C
Molecular Weight1
456.74
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Physical Properties

Property Value Unit Source
ΔfG° 144.42 kJ/mol Joback Calculated Property
ΔfH°gas -646.95 kJ/mol Joback Calculated Property
ΔfusH° 33.55 kJ/mol Joback Calculated Property
ΔvapH° 87.82 kJ/mol Joback Calculated Property
log10WS -8.48 Crippen Calculated Property
logPoct/wat 8.287 Crippen Calculated Property
McVol 400.790 ml/mol McGowan Calculated Property
Pc 904.52 kPa Joback Calculated Property
Inp 3541.00 NIST
Tboil 1021.46 K Joback Calculated Property
Tc 1264.14 K Joback Calculated Property
Tfus 639.27 K Joback Calculated Property
Vc 1.514 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1623.86; 1988.48] J/mol×K [1021.46; 1264.14] Show Hide
Cp,gas 1623.86 J/mol×K 1021.46 Joback Calculated Property
Cp,gas 1673.59 J/mol×K 1061.91 Joback Calculated Property
Cp,gas 1726.86 J/mol×K 1102.35 Joback Calculated Property
Cp,gas 1784.32 J/mol×K 1142.80 Joback Calculated Property
Cp,gas 1846.64 J/mol×K 1183.25 Joback Calculated Property
Cp,gas 1914.47 J/mol×K 1223.69 Joback Calculated Property
Cp,gas 1988.48 J/mol×K 1264.14 Joback Calculated Property

Similar Compounds

17«beta»(H),21«beta»(H)-Homohopanoic acid methyl ester. 28-bishomopan-32-oic acid methyl ester. 17«beta»(H),21«beta»(H)-Bishomohopanoic acid methyl ester. 17«alpha»(H),21«beta»(H)-Bishomohopanoic acid methyl ester. Cholan-24-oic acid, methyl ester, (5«beta»)-. 17«beta»(H),21«alpha»(H)-Bishomohopanoic acid methyl ester. 5«alpha»-Cholanic acid, methyl ester. 17«beta»(H),21«beta»(H)-Trishomohopanoic acid methyl ester. Cholan-24-oic acid, 3-oxo-, methyl ester, (5«beta»)-. 22S-epi-28-Norhopanoic acid methyl ester. 22R-epi-28-Norhopanoic acid methyl ester. 22R-epi-17«beta»(H),21«beta»(H)-Hopanoic acid methyl ester. 22S-epi-17«beta»(H),21«beta»(H)-Hopanoic acid methyl ester. Octanoic acid, 3-methyl, methyl ester. exo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 7,7-dimethyl, methyl ester.

Find more compounds similar to 28-Norhomohopan-31-oic acid methyl ester.

Sources

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