Chemical Properties of 3-(3,4,5-TRIMETHOXYPHENYL)PROPIONIC ACID

3-(3,4,5-TRIMETHOXYPHENYL)PROPIONIC ACID

InChI
InChI=1S/C12H16O5/c1-15-9-6-8(4-5-11(13)14)7-10(16-2)12(9)17-3/h6-7H,4-5H2,1-3H3,(H,13,14)
InChI Key
ZCYXGVJUZBKJAI-UHFFFAOYSA-N
Formula
C12H16O5
SMILES
COc1cc(CCC(=O)O)cc(OC)c1OC
Molecular Weight1
240.26
Other Names
  • 3,4,5-Trimethoxyphenylpropionic acid
  • 3,4,5-trimethoxyhydrocinnamic acid
  • 3-(3,4,5-Trimethoxyphenyl)propanoic acid
  • Benzenepropanoic acid, 3,4,5-trimethoxy-
  • «beta»-(3,4,5-Trimethoxy phenyl)propionic acid
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Physical Properties

Property Value Unit Source
ΔfusH° 33.42 kJ/mol Joback Calculated Property
IE 8.04 eV Relay (1.0) Calculated Property
log10WS -1.77 Relay (1.0) Calculated Property
logPoct/wat 1.730 Crippen Calculated Property
McVol 181.230 ml/mol McGowan Calculated Property
Pc 2388.85 kPa Joback Calculated Property
Tboil 601.83 K Relay (1.0) Calculated Property
Tfus 393.59 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor 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 [500.44; 563.90] J/mol×K [728.55; 937.54] Show Hide
Cp,gas 500.44 J/mol×K 728.55 Joback Calculated Property
Cp,gas 513.02 J/mol×K 763.38 Joback Calculated Property
Cp,gas 524.81 J/mol×K 798.21 Joback Calculated Property
Cp,gas 535.81 J/mol×K 833.05 Joback Calculated Property
Cp,gas 546.00 J/mol×K 867.88 Joback Calculated Property
Cp,gas 555.37 J/mol×K 902.71 Joback Calculated Property
Cp,gas 563.90 J/mol×K 937.54 Joback Calculated Property
η [0.0000829; 0.0003316] Pa×s [516.27; 728.55] Show Hide
η 0.0003316 Pa×s 516.27 Joback Calculated Property
η 0.0002444 Pa×s 551.65 Joback Calculated Property
η 0.0001869 Pa×s 587.03 Joback Calculated Property
η 0.0001474 Pa×s 622.41 Joback Calculated Property
η 0.0001192 Pa×s 657.79 Joback Calculated Property
η 0.0000985 Pa×s 693.17 Joback Calculated Property
η 0.0000829 Pa×s 728.55 Joback Calculated Property

Similar Compounds

3-(3,4-Dimethoxyphenyl)propionic acid. Propanoic acid, 3-(3,4,5-trimethoxyphenyl), methyl ester. 1-Propanol, 3-(3,4,5-trimethoxyphenyl). 3-(3,4-Methylendioxyphenyl)propionic acid. «beta»-(4-Hydroxy-3-methoxyphenyl)propionic acid. 3-(3-Methoxyphenyl)propanoic acid. Benzenepropanoic acid, 3,4-dimethoxy-, methyl ester. 5-(3-Hydroxypropyl)-2,3-dimethoxyphenol. Dihydrosinapyl alcohol. 1,2,6-trimethoxy-4-propylbenzene. Propanal, 3-(4-hydroxy-3,5-dimethoxyphenyl). 3-(3,4-DIMETHOXYPHENYL)-1-PROPANOL. Methyl 3-(4-hydroxy-3-methoxyphenyl)propanoate. Methyl zingerone. 3-(4-Methoxyphenyl)propionic acid.

Find more compounds similar to 3-(3,4,5-TRIMETHOXYPHENYL)PROPIONIC ACID.

Sources

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