Chemical Properties of Methyl abiet-7-en-18-oate

Methyl abiet-7-en-18-oate

InChI
InChI=1S/C21H34O2/c1-14(2)15-7-9-17-16(13-15)8-10-18-20(17,3)11-6-12-21(18,4)19(22)23-5/h8,14-15,17-18H,6-7,9-13H2,1-5H3
InChI Key
YUBSLXLMZVQYAG-UHFFFAOYSA-N
Formula
C21H34O2
SMILES
COC(=O)C1(C)CCCC2(C)C3CCC(C(C)C)CC3=CCC12
Molecular Weight1
318.50
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Physical Properties

Property Value Unit Source
ΔfusH° 25.28 kJ/mol Joback Calculated Property
log10WS -5.41 Relay (1.0) Calculated Property
logPoct/wat 5.375 Crippen Calculated Property
McVol 277.310 ml/mol McGowan Calculated Property
Tfus 349.97 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [906.92; 1054.83] J/mol×K [774.71; 1002.59] Show Hide
Cp,gas 906.92 J/mol×K 774.71 Joback Calculated Property
Cp,gas 932.53 J/mol×K 812.69 Joback Calculated Property
Cp,gas 957.38 J/mol×K 850.67 Joback Calculated Property
Cp,gas 981.76 J/mol×K 888.65 Joback Calculated Property
Cp,gas 1005.94 J/mol×K 926.63 Joback Calculated Property
Cp,gas 1030.21 J/mol×K 964.61 Joback Calculated Property
Cp,gas 1054.83 J/mol×K 1002.59 Joback Calculated Property

Similar Compounds

1-Phenanthrenecarboxylic acid,7-ethenyl-1,2,3,4,4a,4b,5,6,7,8,10,10a-dodecahydro-1,4a-7-trimethyl-, methyl ester. 1-Phenanthrenecarboxylic acid, 7-ethenyl-1,2,3,4,4a,4b,5,6,7,8,10,10a-dodecahydro-1,4a,7-trimethyl-, methyl ester, [1R-(1«alpha»,4a«beta»,4b«alpha»,7«alpha»,10a«alpha»)]-. Methyl 7,15-Isopimaradien-18-oate. 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,8a,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethyl)-, methyl ester, [1R-(1«alpha»,4a«beta»,4b«alpha»,8a«beta»,10a«alpha»)]-. 1-Phenanthrenecarboxylic acid, 7-ethenyl-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a,7-trimethyl-, methyl ester, [1R-(1«alpha»,4a«beta»,4b«alpha»,7«alpha»,10a«alpha»)]-. 1-Phenanthrenecarboxylic acid, 7-ethenyl-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a,7-trimethyl-, methyl ester, [1R-(1«alpha»,4a«beta»,4b«alpha»,7«beta»,10a«alpha»)]-. 1-Phenanthrenecarboxylic acid, 7-ethyl-1,2,3,4,4a,5,6,7,8,9,10,10a-dodecahydro-1,4a,7-trimethyl-, methyl ester, [1R-(1«alpha»,4a«beta»,7«beta»,10a«alpha»)]-. Methyl abietate. Methyl abieta-7,13-dien-18-oate. Methyl 13«beta»-Abieta-7,9(11)dien-18-oate. 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethylidene)-, methyl ester, [1R-(1«alpha»,4a«beta»,4b«alpha»,10a«alpha»)]-. Methyl 8(14),13(15)-Abietadien-18-oate. 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,9,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-, methyl ester, [1R-(1«alpha»,4a«beta»,4b«alpha»,10a«alpha»)]-. Methyl 8(14),12-Abietadien-18-oate. 1-Naphthalenecarboxylic acid, decahydro-1,4a-dimethyl-6-methylene-5-(3-methyl-2,4-pentadienyl)-, methyl ester, [1S-[1«alpha»,4a«alpha»,5«alpha»(E),8a«beta»]]-.

Find more compounds similar to Methyl abiet-7-en-18-oate.

Sources

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