Chemical Properties of 4a«alpha»,4b«beta»-Gibbane-1«alpha»,10«beta»-dicarboxylic acid, 1,4a-dimethyl-8-methylene-, dimethyl ester (CAS 22882-62-8)

4a«alpha»,4b«beta»-Gibbane-1«alpha»,10«beta»-dicarboxylic acid, 1,4a-dimethyl-8-methylene-, dimethyl ester

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InChI
InChI=1S/C22H32O4/c1-13-11-22-12-14(13)7-8-15(22)20(2)9-6-10-21(3,19(24)26-5)17(20)16(22)18(23)25-4/h14-17H,1,6-12H2,2-5H3
InChI Key
PWWAKLGQWQLLIY-UHFFFAOYSA-N
Formula
C22H32O4
SMILES
C=C1CC23CC1CCC2C1(C)CCCC(C)(C(=O)OC)C1C3C(=O)OC
Molecular Weight1
360.49
CAS
22882-62-8
Other Names
  • Dimethyl 1,4a-dimethyl-8-methylenegibbane-1,10-dicarboxylate, (1«alpha»,4a«alpha»,4b«beta»,10«beta»)-
  • GA12 methyl ester
  • GA12, Me
Sources

Physical Properties

Property Value Unit Source
Δf -113.30 kJ/mol Joback Calculated Property
Δfgas -645.35 kJ/mol Joback Calculated Property
Δfus 27.71 kJ/mol Joback Calculated Property
Δvap 78.83 kJ/mol Joback Calculated Property
logPoct/wat 4.138 Crippen Calculated Property
Pc 1493.04 kPa Joback Calculated Property
Tboil 880.98 K Joback Calculated Property
Tc 1113.24 K Joback Calculated Property
Tfus 615.88 K Joback Calculated Property
Vc 1.095 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1014.49 J/mol×K 880.98 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
>C=O (nonring) 2
=CH2 1
=C< (ring) 1
>C< (ring) 3
-CH3 4
>CH- (ring) 4
-CH2- (ring) 7

Similar Compounds

GA24 methyl ester. GA24, Methylated. [14C4]GA24 methyl ester. [14C] GA24 methyl ester. 4a«alpha»,4b«beta»-Gibbane-1«alpha»,10«beta»-dicarboxylic acid, 4a-formyl-1-methyl-8-methylene-, dimethyl ester. [14C1]GA25 methyl ester. GA25, Me. [14C] GA25 methyl ester. GA12 aldehyde, Me-TMS. Gibbane-1,10-dicarboxylic acid, 4a-(hydroxymethyl)-1-methyl-8-methylene-, 1,4a-lactone, 10-methyl ester, (1«alpha»,4a«alpha»,4b«beta»,10«beta»)-. [14C4]GA15 methyl ester TMS ether. [14C] GA15, methyl ester. ent-Kaurenoic acid, isomer, methyl ester. Kaurenic acid, Me-TMS. methyl (4«beta»)-kaur-16-en-18-oate.

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