Chemical Properties of 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»)]- (CAS 3582-25-0)

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»)]-

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InChI
InChI=1S/C21H34O2/c1-6-19(2)13-10-16-15(14-19)8-9-17-20(16,3)11-7-12-21(17,4)18(22)23-5/h17H,6-14H2,1-5H3
InChI Key
LZUSHGHGVLPXFI-UHFFFAOYSA-N
Formula
C21H34O2
SMILES
CCC1(C)CCC2=C(CCC3C(C)(C(=O)OC)CCCC23C)C1
Molecular Weight1
318.49
CAS
3582-25-0
Other Names
  • Podocarp-8-en-15-oic acid, 13«beta»-ethyl-13-methyl-, methyl ester
  • Methyl 8-pimaren-18-oate
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Physical Properties

Property Value Unit Source
ω 0.4948 Relay (... Calculated Property
ΔfG° 0.29 kJ/mol Joback Calculated Property
ΔfH°gas -521.94 kJ/mol Relay (... Calculated Property
ΔfusH° 19.46 kJ/mol Joback Calculated Property
ΔvapH° 95.92 kJ/mol Relay (... Calculated Property
IE 8.06 eV Relay (... Calculated Property
log10WS -4.95 Relay (... Calculated Property
logPoct/wat 5.663 Crippen Calculated Property
McVol 277.310 ml/mol McGowan Calculated Property
Pc 1519.94 kPa Joback Calculated Property
Inp [2266.00; 2266.00]   Show Hide
Inp 2266.00 NIST
Inp 2266.00 NIST
Tboil 610.33 K Relay (... Calculated Property
Tc 866.59 K Relay (... Calculated Property
Tfus 374.01 K Relay (... Calculated Property
Vc 0.980 m3/kmol Relay (... Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [909.00; 1079.16] J/mol×K [802.91; 1036.25] Show Hide
Cp,gas 909.00 J/mol×K 802.91 Joback Calculated Property
Cp,gas 935.45 J/mol×K 841.80 Joback Calculated Property
Cp,gas 962.13 J/mol×K 880.69 Joback Calculated Property
Cp,gas 989.43 J/mol×K 919.58 Joback Calculated Property
Cp,gas 1017.77 J/mol×K 958.47 Joback Calculated Property
Cp,gas 1047.55 J/mol×K 997.36 Joback Calculated Property
Cp,gas 1079.16 J/mol×K 1036.25 Joback Calculated Property

Similar Compounds

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»)]-. Methyl abiet-7-en-18-oate. 13Alpha-delta(8)-dihydroabietic acid. 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,5,6,7,8,10,10a-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,5,6,7,8,10,10a-dodecahydro-1,4a-7-trimethyl-, methyl ester. Methyl 7,15-Isopimaradien-18-oate. Methyl palustrate. Methyl 8,13-Abietadien-18-oate. 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»)]-. Methyl 13«beta»-Abieta-7,9(11)dien-18-oate. (S)-Ethyl 3-methyl-5-((4aS,8aS)-2,5,5,8a-tetramethyl-3,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)pentanoate. Methyl 8(14),13(15)-Abietadien-18-oate.

Find more compounds similar to 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»)]-.

Sources

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