Chemical Properties of 2-Propenoic acid, 3-(3,4-dimethoxyphenyl)-, methyl ester (CAS 5396-64-5)

2-Propenoic acid, 3-(3,4-dimethoxyphenyl)-, methyl ester

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C12H14O4/c1-14-10-6-4-9(8-11(10)15-2)5-7-12(13)16-3/h4-8H,1-3H3/b7-5+
InChI Key
JXRYDOZRPYFBKO-FNORWQNLSA-N
Formula
C12H14O4
SMILES
COC(=O)C=Cc1ccc(OC)c(OC)c1
Molecular Weight1
222.24
CAS
5396-64-5
Other Names
  • 3,4-Dimethoxy methyl cinnamate
  • 3,4-Dimethoxy-trans-cinnamic acid,methyl ester
  • 3,4-O-Dimethylcaffeic acid methyl ester
  • Cinnamic acid, 3,4-dimethoxy-, methyl ester
  • Methyl 3,4-dimethoxycinnamate
  • Methyl 3-(3,4-dimethoxyphenyl)-2-propenoate
  • Methyl 3-(3,4-dimethoxyphenyl)-prop-2-enoate
  • Methyl 3-(3,4-dimethoxyphenyl)acrylate
  • Methyl ester of 3,4-Dimethoxycinnamic acid
Sources

Physical Properties

Property Value Unit Source
Δf -220.39 kJ/mol Joback Calculated Property
Δfgas -469.44 kJ/mol Joback Calculated Property
Δfus 25.46 kJ/mol Joback Calculated Property
Δvap 59.84 kJ/mol Joback Calculated Property
logPoct/wat 1.89 Crippen Calculated Property
Pc 2487.55 kPa Joback Calculated Property
Tboil 635.89 K Joback Calculated Property
Tc 847.87 K Joback Calculated Property
Tfus 388.00 K Joback Calculated Property
Vc 0.64 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 422.99 J/mol×K 635.89 Joback Calculated Property
η 0.00 Pa×s 635.89 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 3
>C=O (nonring) 1
=CH- (ring) 3
=C< (ring) 3
=CH- 2
-CH3 3

Similar Compounds

2-Propenoic acid, 3-(3,4,5-trimethoxyphenyl)-, methyl ester, cis. 2-Propenoic acid, 3-(3,4-dimethoxyphenyl)-, methyl ester, trans. Ethyl 3-(3,4-dimethoxyphenyl)acrylate. 2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, methyl ester. (Z)-3,4-Dimethoxycinnamic acid. 3,4-Dimethoxycinnamic acid. 2-Propenoic acid, 3-(3,4-dimethoxyphenyl)-, (E)-. Ferulic acid ethyl ester. 2-Propenoic acid, 3-(3,4,5-trimethoxyphenyl)-, methyl ester. 2-Propenoic, 3-(3, 4, 5 trimethoxy phenyl) methylester. 2-Propenoic acid, 3-(3,4-dimethoxyphenyl)-, methyl ester, cis. 2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-. trans-Ferulic acid. Methyl 4-hydroxy-3,5-dimethoxycinnamate (methyl sinapate). 3-(3,4-dimethoxyphenyl)-2-propenal.

Find more compounds similar to 2-Propenoic acid, 3-(3,4-dimethoxyphenyl)-, methyl ester.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.