Chemical Properties of Methyl jasmonate (CAS 1211-29-6)

Methyl jasmonate

InChI
InChI=1S/C13H20O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h4-5,10-11H,3,6-9H2,1-2H3/b5-4+/t10-,11-/m0/s1
InChI Key
GEWDNTWNSAZUDX-NNOMMRTBSA-N
Formula
C13H20O3
SMILES
CCC=CCC1C(=O)CCC1CC(=O)OC
Molecular Weight1
224.30
CAS
1211-29-6
Other Names
  • Cyclopentaneacetic acid, 3-oxo-2-(2-pentenyl)-, methyl ester, [1R-[1«alpha»,2«beta»(Z)]]-
  • Cyclopentaneacetic acid, 3-oxo-2-(2Z)-2-penten-1-yl-, methyl ester, (1R,2R)-
  • Cyclopentaneacetic acid, 3-oxo-trans-2-(cis-2-pentenyl), methyl ester
  • Z-Methyl jasmonoate
  • Methyl cis-jasmonate
  • methyl [1R-[1«alpha»,2«beta»(Z)]]-3-oxo-2-(pent-2-enyl)cyclopentaneacetate
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Physical Properties

Property Value Unit Source
ΔfusH° 28.51 kJ/mol Joback Calculated Property
logPoct/wat 2.501 Crippen Calculated Property
McVol 187.880 ml/mol McGowan Calculated Property
Inp [1606.00; 1655.40]   Show Hide
Inp 1655.40 NIST
Inp 1629.00 NIST
Inp 1629.00 NIST
Inp 1606.00 NIST
Inp 1644.00 NIST
Inp 1615.00 NIST
Inp 1611.00 NIST
Inp 1611.00 NIST
Inp 1652.00 NIST
Inp 1607.00 NIST
Inp 1638.00 NIST
Inp 1612.00 NIST
Inp 1612.00 NIST
Inp 1655.40 NIST
I [2303.00; 2345.00]   Show Hide
I 2338.00 NIST
I 2338.00 NIST
I 2303.00 NIST
I 2332.00 NIST
I 2345.00 NIST
I 2303.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [516.59; 610.61] J/mol×K [637.85; 846.12] Show Hide
Cp,gas 516.59 J/mol×K 637.85 Joback Calculated Property
Cp,gas 534.86 J/mol×K 672.56 Joback Calculated Property
Cp,gas 552.08 J/mol×K 707.27 Joback Calculated Property
Cp,gas 568.25 J/mol×K 741.98 Joback Calculated Property
Cp,gas 583.40 J/mol×K 776.69 Joback Calculated Property
Cp,gas 597.51 J/mol×K 811.41 Joback Calculated Property
Cp,gas 610.61 J/mol×K 846.12 Joback Calculated Property

Similar Compounds

Methyl epi-jasmonate. Methyl (Z)-epi-jasmonate. methyl epijasmonate. Cyclopentaneacetic acid, 3-oxo-2-(2-pentenyl)-, methyl ester, [1«alpha»,2«alpha»(Z)]-. (+)-Jasmonic acid, methyl ester (cis). (+)-(Z)-Methyl epijasmonate. (-)-Jasmonic acid, methyl ester (trans). (Z)-Methyl epi-jasmonate. Methyl (Z)-jasmonate. (E)-methyl jasmonate. (Z)-methyl jasmonate. (Z)-Methyl epi-jasmonate. trans-Dihydrojasmone. Bicyclo[2.2.1]hept-5-ene-2-carboxylic acid, methyl ester, exo-. Bicyclo[2.2.1]hept-5-ene-2-carboxylic acid, methyl ester, endo-.

Find more compounds similar to Methyl jasmonate.

Sources

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