Chemical Properties of Methyl 13-Abieten-18-oate (CAS 33892-18-1)

Methyl 13-Abieten-18-oate

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

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/h13-14,16-18H,6-12H2,1-5H3
InChI Key
MARRJGBPDCCAEK-UHFFFAOYSA-N
Formula
C21H34O2
SMILES
COC(=O)C1(C)CCCC2(C)C3CCC(C(C)C)=CC3CCC12
Molecular Weight1
318.49
CAS
33892-18-1
Other Names
  • Methyl 13-abieten-18-oate
  • Methyl dihydroabietate
  • Podocarp-13-en-15-oic acid, 13-isopropyl-, methyl ester
Sources

Physical Properties

Property Value Unit Source
Δf 5.26 kJ/mol Joback Calculated Property
Δfgas -503.14 kJ/mol Joback Calculated Property
Δfus 23.69 kJ/mol Joback Calculated Property
Δvap 69.74 kJ/mol Joback Calculated Property
logPoct/wat 5.37 Crippen Calculated Property
Pc 1456.79 kPa Joback Calculated Property
Tboil 792.58 K Joback Calculated Property
Tc 1022.06 K Joback Calculated Property
Tfus 472.41 K Joback Calculated Property
Vc 1.04 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 916.37 J/mol×K 792.58 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 1
-CH3 5
=CH- (ring) 1
=C< (ring) 1
>C< (ring) 2
>C=O (nonring) 1
>CH- (ring) 3
-CH2- (ring) 7

Similar Compounds

Methyl abiet-7-en-18-oate. 1-Phenanthrenecarboxylic acid,7-ethenyl-1,2,3,4,4a,4b,5,6,7,8,10,10a-dodecahydro-1,4a-7-trimethyl-, methyl ester. Methyl 7,15-Isopimaradien-18-oate. 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»)]-. 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 8,15-Isopimaradien-18-oate. 1-Phenanthrenecarboxylic acid, 7-ethenyl-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»)]-. 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»]]-. ent-Kaurenoic acid, isomer, methyl ester. methyl (4«beta»)-kaur-16-en-18-oate. Kaurenic acid, Me-TMS. Kaur-16-en-18-oic acid, methyl ester, (4«beta»)-. Methyl 8(14),12-Abietadien-18-oate.

Find more compounds similar to Methyl 13-Abieten-18-oate.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.