Chemical Properties of 22S-epi-17«beta»(H),21«beta»(H)-Hopanoic acid methyl ester

22S-epi-17«beta»(H),21«beta»(H)-Hopanoic acid methyl ester

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InChI
InChI=1S/C31H52O2/c1-20(26(32)33-8)21-12-17-28(4)22(21)13-18-30(6)24(28)10-11-25-29(5)16-9-15-27(2,3)23(29)14-19-31(25,30)7/h20-25H,9-19H2,1-8H3/t20-,21-,22+,23?,24?,25?,28+,29+,30-,31-/m0/s1
InChI Key
YUHMMAGHEGZDPT-HNQONKNXSA-N
Formula
C31H52O2
SMILES
COC(=O)C(C)C1CCC2(C)C1CCC1(C)C2CCC2C3(C)CCCC(C)(C)C3CCC21C
Molecular Weight1
456.74
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Physical Properties

Property Value Unit Source
Δf 138.93 kJ/mol Joback Calculated Property
Δfgas -631.71 kJ/mol Joback Calculated Property
Δfus 27.25 kJ/mol Joback Calculated Property
Δvap 86.67 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 929.51 kPa Joback Calculated Property
Inp [3582.00; 3582.00]   Show Hide
Inp 3582.00 NIST
Inp 3582.00 NIST
Tboil 1021.70 K Joback Calculated Property
Tc 1268.46 K Joback Calculated Property
Tfus 663.17 K Joback Calculated Property
Vc 1.512 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1634.26; 2068.33] J/mol×K [1021.70; 1268.46] Show Hide
Cp,gas 1634.26 J/mol×K 1021.70 Joback Calculated Property
Cp,gas 1691.17 J/mol×K 1062.83 Joback Calculated Property
Cp,gas 1753.16 J/mol×K 1103.95 Joback Calculated Property
Cp,gas 1821.06 J/mol×K 1145.08 Joback Calculated Property
Cp,gas 1895.67 J/mol×K 1186.21 Joback Calculated Property
Cp,gas 1977.82 J/mol×K 1227.33 Joback Calculated Property
Cp,gas 2068.33 J/mol×K 1268.46 Joback Calculated Property

Similar Compounds

22R-epi-17«beta»(H),21«beta»(H)-Hopanoic acid methyl ester. 22S-epi-28-Norhopanoic acid methyl ester. 22R-epi-28-Norhopanoic acid methyl ester. endo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 7,7-dimethyl, methyl ester. exo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 7,7-dimethyl, methyl ester. Cyclocopacamphan-12-yl methyl ether, A. Cyclocopacamphan-12-yl methyl ether, B. Hexadecanoic acid, 2,3,4-trimethyl-, methyl ester. Methyl cyclocopacamphanoate. [14C] GA25 16«alpha», 17-H2, 17-OH , methyl ester. endo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 7,7-cyclopropano, methyl ester. exo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 7,7-cyclopropano-, methyl ester. Bicyclo[2.2.1]heptane-2-carboxylic acid, methyl ester. endo-Bicyclo[2.2.1]heptan-2-carboxylic acid, methyl ester. Methyl cyclohexanecarboxylate, 4-(1,1-dimethylethyl), # 2.

Find more compounds similar to 22S-epi-17«beta»(H),21«beta»(H)-Hopanoic acid methyl ester.

Sources

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