Chemical Properties of 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»]]- (CAS 15798-13-7)

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»]]-

InChI
InChI=1S/C21H32O2/c1-7-15(2)9-11-17-16(3)10-12-18-20(17,4)13-8-14-21(18,5)19(22)23-6/h7,9,17-18H,1,3,8,10-14H2,2,4-6H3/b15-9+
InChI Key
WYJKGKPQXWDIQP-OQLLNIDSSA-N
Formula
C21H32O2
SMILES
C=CC(C)=CCC1C(=C)CCC2C(C)(C(=O)OC)CCCC12C
Molecular Weight1
316.48
CAS
15798-13-7
Other Names
  • Labda-8(20),12,14-trien-19-oic acid, methyl ester, (E)-
  • Methyl communate
  • Methyl trans-communate
  • Methyl 8(17), E-12,14-labdatrien-19-oate
  • Methyl ester of trans-communic acid
  • (E)-Methyl communate
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Physical Properties

Property Value Unit Source
ΔfusH° 28.38 kJ/mol Joback Calculated Property
logPoct/wat 5.461 Crippen Calculated Property
McVol 279.570 ml/mol McGowan Calculated Property
Inp [2234.00; 2256.00]   Show Hide
Inp 2256.00 NIST
Inp 2234.00 NIST
Inp 2256.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [370.38; 1014.14] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-1.94439e+02
Coefficient B2.62068e+00
Coefficient C-2.24980e-03
Coefficient D8.37700e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 370.38 J/mol×K 273.00 Calculated Property
Cp,gas 488.21 J/mol×K 353.78 Calculated Property
Cp,gas 588.29 J/mol×K 434.56 Calculated Property
Cp,gas 673.25 J/mol×K 515.33 Calculated Property
Cp,gas 745.76 J/mol×K 596.11 Calculated Property
Cp,gas 808.46 J/mol×K 676.89 Calculated Property
Cp,gas 864.00 J/mol×K 757.67 Calculated Property
Cp,gas 915.03 J/mol×K 838.44 Calculated Property
Cp,gas 964.19 J/mol×K 919.22 Calculated Property
Cp,gas 1014.14 J/mol×K 1000.00 Calculated Property

Similar Compounds

(1S,4aR,5S,8aR)-1,4a-Dimethyl-6-methylene-5-((E)-3-methylpenta-2,4-dien-1-yl)decahydronaphthalene-1-carboxylic acid. 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»)]-. Methyl abieta-7,13-dien-18-oate. Methyl abietate. 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»)]-. Methyl 8(14),13(15)-Abietadien-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»)]-. Methyl 13«beta»-Abieta-7,9(11)dien-18-oate. Methyl 8,13-Abietadien-18-oate.

Find more compounds similar to 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»]]-.

Sources

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