Chemical Properties of GA25, Me

GA25, Me

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InChI
InChI=1S/C23H32O6/c1-13-11-22-12-14(13)7-8-15(22)23(20(26)29-5)10-6-9-21(2,19(25)28-4)17(23)16(22)18(24)27-3/h14-17H,1,6-12H2,2-5H3/t14-,15?,16-,17?,21-,22+,23-/m1/s1
InChI Key
CVVOOYMCPNGYQG-RXILWBLMSA-N
Formula
C23H32O6
SMILES
C=C1CC23CC1CCC2C1(C(=O)OC)CCCC(C)(C(=O)OC)C1C3C(=O)OC
Molecular Weight1
404.50
Other Names
  • GA25 methyl ester

Physical Properties

Property Value Unit Source
Δf -338.80 kJ/mol Joback Calculated Property
Δfgas -910.79 kJ/mol Joback Calculated Property
Δfus 33.09 kJ/mol Joback Calculated Property
Δvap 90.21 kJ/mol Joback Calculated Property
log10WS -3.78 Crippen Calculated Property
logPoct/wat 3.291 Crippen Calculated Property
McVol 309.510 ml/mol McGowan Calculated Property
Pc 1436.98 kPa Joback Calculated Property
Inp [2428.00; 2476.00]   Show Hide
Inp 2449.00 NIST
Inp 2440.00 NIST
Inp 2440.00 NIST
Inp 2443.00 NIST
Inp 2443.00 NIST
Inp 2440.00 NIST
Inp Outlier 2476.00 NIST
Inp 2428.00 NIST
Inp 2460.00 NIST
Inp 2431.00 NIST
Inp 2432.00 NIST
Inp 2430.00 NIST
Inp 2437.00 NIST
Inp 2437.00 NIST
Inp 2439.00 NIST
Inp Outlier 2474.00 NIST
Inp 2470.00 NIST
Inp 2442.00 NIST
Inp 2440.00 NIST
Inp 2432.00 NIST
Tboil 980.15 K Joback Calculated Property
Tc 1216.30 K Joback Calculated Property
Tfus 699.31 K Joback Calculated Property
Vc 1.175 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1147.01; 1375.16] J/mol×K [980.15; 1216.30] Show Hide
Cp,gas 1147.01 J/mol×K 980.15 Joback Calculated Property
Cp,gas 1178.78 J/mol×K 1019.51 Joback Calculated Property
Cp,gas 1212.49 J/mol×K 1058.87 Joback Calculated Property
Cp,gas 1248.56 J/mol×K 1098.23 Joback Calculated Property
Cp,gas 1287.41 J/mol×K 1137.58 Joback Calculated Property
Cp,gas 1329.47 J/mol×K 1176.94 Joback Calculated Property
Cp,gas 1375.16 J/mol×K 1216.30 Joback Calculated Property

Similar Compounds

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

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Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.

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