Chemical Properties of (2E,4E)-Methyl 5-(benzo[d][1,3]dioxol-5-yl)penta-2,4-dienoate (CAS 6190-46-1)

(2E,4E)-Methyl 5-(benzo[d][1,3]dioxol-5-yl)penta-2,4-dienoate

InChI
InChI=1S/C13H12O4/c1-15-13(14)5-3-2-4-10-6-7-11-12(8-10)17-9-16-11/h2-8H,9H2,1H3/b4-2+,5-3+
InChI Key
VOZJBFJHMHRLDN-ZUVMSYQZSA-N
Formula
C13H12O4
SMILES
COC(=O)C=CC=Cc1ccc2c(c1)OCO2
Molecular Weight1
232.23
CAS
6190-46-1
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Physical Properties

Property Value Unit Source
ΔfusH° 38.90 kJ/mol Joback Calculated Property
log10WS -4.04 Relay (1.0) Calculated Property
logPoct/wat 2.158 Crippen Calculated Property
McVol 169.990 ml/mol McGowan Calculated Property
Inp [2081.70; 2081.70]   Show Hide
Inp 2081.70 NIST
Inp 2081.70 NIST
Tboil 594.61 K Relay (1.0) Calculated Property
Tfus 401.35 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [440.74; 505.37] J/mol×K [683.40; 915.31] Show Hide
Cp,gas 440.74 J/mol×K 683.40 Joback Calculated Property
Cp,gas 453.47 J/mol×K 722.05 Joback Calculated Property
Cp,gas 465.30 J/mol×K 760.70 Joback Calculated Property
Cp,gas 476.31 J/mol×K 799.35 Joback Calculated Property
Cp,gas 486.60 J/mol×K 838.01 Joback Calculated Property
Cp,gas 496.26 J/mol×K 876.66 Joback Calculated Property
Cp,gas 505.37 J/mol×K 915.31 Joback Calculated Property
η [0.0002326; 0.0013437] Pa×s [425.05; 683.40] Show Hide
η 0.0013437 Pa×s 425.05 Joback Calculated Property
η 0.0008770 Pa×s 468.11 Joback Calculated Property
η 0.0006150 Pa×s 511.17 Joback Calculated Property
η 0.0004558 Pa×s 554.23 Joback Calculated Property
η 0.0003527 Pa×s 597.28 Joback Calculated Property
η 0.0002825 Pa×s 640.34 Joback Calculated Property
η 0.0002326 Pa×s 683.40 Joback Calculated Property

Similar Compounds

6-(Benzo[d][1,3]dioxol-5-yl)hexa-3,5-dien-2-one. 2-Propenal, 3-(1,3-benzodioxol-5-yl)-. Benzene, 1,2-(methylenedioxy)-4-propenyl-, (E)-. 1,3-Benzodioxole, 5-(1-propenyl)-. 1,3-Benzodioxole, 5-(1-propenyl)-, (Z)-. 3,4-Methylenedioxycinnamic acid. (Z)-1-(3',4'-Dimethoxyphenyl)butadiene. (E)-1-(3,4-dimethoxyphenyl)butadiene. (2E,4E)-5-(Benzo[d][1,3]dioxol-5-yl)-N-isobutylpenta-2,4-dienamide. 3,4-Methylenedioxybenzylidene acetone. Chavicine. Piperine. Pyrrolidine, 1-[5-(1,3-benzodioxol-5-yl)-1-oxo-2,4-pentadienyl]-, (E,E)-. 2-Propenoic acid, 3-(3,4-dimethoxyphenyl)-, methyl ester, trans. 2-Propenoic acid, 3-(3,4,5-trimethoxyphenyl)-, methyl ester, cis.

Find more compounds similar to (2E,4E)-Methyl 5-(benzo[d][1,3]dioxol-5-yl)penta-2,4-dienoate.

Sources

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