- InChI
- InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)
- InChI Key
- KSEBMYQBYZTDHS-UHFFFAOYSA-N
- Formula
- C10H10O4
- SMILES
- COc1cc(C=CC(=O)O)ccc1O
- Molecular Weight1
- 194.18
- CAS
- 1135-24-6
- Other Names
-
- 3-(4-Hydroxy-3-methoxyphenyl)-2-propenoic acid
- 3-(4-hydroxy-3-methoxyphenyl)acrylic acid
- 3-Methoxy-4-hydroxycinnamic acid
- 4-Hydroxy-3-methoxycinnamic acid (ferulic acid)
- 4-hydroxy-3-methoxycinnamic acid
- Cinnamic acid, 4-hydroxy-3-methoxy-
- coniferic acid
- ferulaic acid
- ferulic acid
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔfusH : Enthalpy of fusion at a given temperature (kJ/mol).
- ΔsubH : Enthalpy of sublimation at a given temperature (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Psub : Sublimation pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | -309.04 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -481.79 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.60 | kJ/mol | Joback Calculated Property |
| log10WS | -1.48 | Crippen Calculated Property | |
| logPoct/wat | 1.499 | Crippen Calculated Property | |
| McVol | 142.880 | ml/mol | McGowan Calculated Property |
| Pc | 4311.22 | kPa | Joback Calculated Property |
| Inp | 1897.10 | NIST | |
| Tboil | 713.11 | K | Joback Calculated Property |
| Tc | 929.21 | K | Joback Calculated Property |
| Tfus | [444.90; 445.90] | K |
|
| Tfus | 445.90 | K | Thermod... |
| Tfus | 444.90 | K | Solubil... |
| Vc | 0.476 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [370.82; 418.28] | J/mol×K | [713.11; 929.21] |
|
| Cp,gas | 370.82 | J/mol×K | 713.11 | Joback Calculated Property |
| Cp,gas | 379.79 | J/mol×K | 749.13 | Joback Calculated Property |
| Cp,gas | 388.25 | J/mol×K | 785.14 | Joback Calculated Property |
| Cp,gas | 396.26 | J/mol×K | 821.16 | Joback Calculated Property |
| Cp,gas | 403.89 | J/mol×K | 857.18 | Joback Calculated Property |
| Cp,gas | 411.21 | J/mol×K | 893.20 | Joback Calculated Property |
| Cp,gas | 418.28 | J/mol×K | 929.21 | Joback Calculated Property |
| η | [0.0000039; 0.0001970] | Pa×s | [481.02; 713.11] |
|
| η | 0.0001970 | Pa×s | 481.02 | Joback Calculated Property |
| η | 0.0000802 | Pa×s | 519.70 | Joback Calculated Property |
| η | 0.0000369 | Pa×s | 558.38 | Joback Calculated Property |
| η | 0.0000188 | Pa×s | 597.07 | Joback Calculated Property |
| η | 0.0000104 | Pa×s | 635.75 | Joback Calculated Property |
| η | 0.0000062 | Pa×s | 674.43 | Joback Calculated Property |
| η | 0.0000039 | Pa×s | 713.11 | Joback Calculated Property |
| ΔfusH | [17.89; 33.34] | kJ/mol | [435.30; 444.60] |
|
| ΔfusH | 17.89 | kJ/mol | 435.30 | NIST |
| ΔfusH | 33.34 | kJ/mol | 444.60 | NIST |
| ΔsubH | 132.40 ± 1.30 | kJ/mol | 379.50 | NIST |
| Psub | [2.26e-05; 2.42e-04] | kPa | [368.70; 389.80] |
|
| Psub | 2.47e-05 | kPa | 368.70 | Vapor P... |
| Psub | 2.26e-05 | kPa | 369.10 | Vapor P... |
| Psub | 2.73e-05 | kPa | 369.20 | Vapor P... |
| Psub | 3.88e-05 | kPa | 373.00 | Vapor P... |
| Psub | 3.84e-05 | kPa | 373.20 | Vapor P... |
| Psub | 4.08e-05 | kPa | 373.30 | Vapor P... |
| Psub | 4.83e-05 | kPa | 375.20 | Vapor P... |
| Psub | 5.23e-05 | kPa | 375.30 | Vapor P... |
| Psub | 6.46e-05 | kPa | 377.20 | Vapor P... |
| Psub | 5.96e-05 | kPa | 377.20 | Vapor P... |
| Psub | 6.46e-05 | kPa | 377.40 | Vapor P... |
| Psub | 7.97e-05 | kPa | 379.30 | Vapor P... |
| Psub | 8.13e-05 | kPa | 379.40 | Vapor P... |
| Psub | 1.04e-04 | kPa | 381.30 | Vapor P... |
| Psub | 1.02e-04 | kPa | 381.40 | Vapor P... |
| Psub | 1.00e-04 | kPa | 381.60 | Vapor P... |
| Psub | 1.24e-04 | kPa | 383.20 | Vapor P... |
| Psub | 1.20e-04 | kPa | 383.40 | Vapor P... |
| Psub | 1.30e-04 | kPa | 383.60 | Vapor P... |
| Psub | 1.56e-04 | kPa | 385.40 | Vapor P... |
| Psub | 1.64e-04 | kPa | 385.60 | Vapor P... |
| Psub | 1.62e-04 | kPa | 385.70 | Vapor P... |
| Psub | 1.96e-04 | kPa | 387.50 | Vapor P... |
| Psub | 1.88e-04 | kPa | 387.50 | Vapor P... |
| Psub | 1.96e-04 | kPa | 387.70 | Vapor P... |
| Psub | 2.42e-04 | kPa | 389.50 | Vapor P... |
| Psub | 2.35e-04 | kPa | 389.80 | Vapor P... |
| Psub | 2.42e-04 | kPa | 389.80 | Vapor P... |
Similar Compounds
Find more compounds similar to 2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-.
Mixtures
- 2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)- + Propanoic acid, 2-hydroxy-, ethyl ester + Water
- 2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)- + Water
- potassium chloride + 2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)- + Water
- 2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)- + sodium chloride + Water
- 2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)- + lithium chloride + Water
- 2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)- + Carbon dioxide
Sources
- Crippen Method
- Crippen Method
- Thermodynamics of a model biological reaction: A comprehensive combined experimental and theoretical study
- Temperature and salt addition effects on the solubility behaviour of some phenolic compounds in water
- Solubility of high-value compounds in ethyl lactate: Measurements and modelling
- Solubility of high-value compounds in environmentally friendly solvents liquid poly(ethylene glycol) and ionic liquids: Experimental study and thermodynamic analysis
- Solubility of Ferulic Acid and Tetramethylpyrazine in Supercritical Carbon Dioxide
- Vapor Pressure Characterization of Several Phenolics and Polyhydric Compounds by Knudsen Effusion Method
- Joback Method
- McGowan Method
- NIST Webbook
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