Chemical Properties of Methyl 8(14),13(15)-Abietadien-18-oate

Methyl 8(14),13(15)-Abietadien-18-oate

InChI
InChI=1S/C21H32O2/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/h13,17-18H,6-12H2,1-5H3/t17?,18-,20-,21-/m0/s1
InChI Key
XLNYKQDSHLEWFW-AFUJVPCRSA-N
Formula
C21H32O2
SMILES
COC(=O)C1(C)CCCC2(C)C3CCC(=C(C)C)C=C3CCC12
Molecular Weight1
316.48
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Physical Properties

Property Value Unit Source
ΔfusH° 26.74 kJ/mol Joback Calculated Property
logPoct/wat 5.439 Crippen Calculated Property
McVol 273.010 ml/mol McGowan Calculated Property
Inp [2387.00; 2387.00]   Show Hide
Inp 2387.00 NIST
Inp 2387.00 NIST
Tfus 359.16 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, Log10 of Water solubility in mol/l 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 [878.23; 1024.12] J/mol×K [786.34; 1019.09] Show Hide
Cp,gas 878.23 J/mol×K 786.34 Joback Calculated Property
Cp,gas 902.84 J/mol×K 825.13 Joback Calculated Property
Cp,gas 926.92 J/mol×K 863.92 Joback Calculated Property
Cp,gas 950.78 J/mol×K 902.72 Joback Calculated Property
Cp,gas 974.73 J/mol×K 941.51 Joback Calculated Property
Cp,gas 999.07 J/mol×K 980.30 Joback Calculated Property
Cp,gas 1024.12 J/mol×K 1019.09 Joback Calculated Property

Similar Compounds

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»)]-. 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethylidene)-, [1R-(1«alpha»,4a«beta»,4b«alpha»,10a«alpha»)]-. Methyl palustrate. Methyl 8,13-Abietadien-18-oate. Methyl abietate. Methyl abieta-7,13-dien-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-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethenyl)-, methyl ester, [1R-(1«alpha»,4a«beta»,4b«alpha»,10a«alpha»)]-. 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»]]-. Methyl 13«beta»-Abieta-7,9(11)dien-18-oate. Abietic acid. 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-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»)]-. ((1S,4aR,4bS,10aR)-1,4a-Dimethyl-7-(propan-2-ylidene)-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydrophenanthren-1-yl)methyl acetate.

Find more compounds similar to Methyl 8(14),13(15)-Abietadien-18-oate.

Sources

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