- InChI
- InChI=1S/C14H16O4/c1-3-5-10-18-14(16)12-8-6-11(7-9-12)13(15)17-4-2/h3,6-9H,1,4-5,10H2,2H3
- InChI Key
- KJIHSRJQMXXEGN-UHFFFAOYSA-N
- Formula
- C14H16O4
- SMILES
- C=CCCOC(=O)c1ccc(C(=O)OCC)cc1
- Molecular Weight1
- 248.27
- 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).
- 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).
- 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° | -210.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -471.40 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.34 | kJ/mol | Joback Calculated Property |
| log10WS | -3.48 | Crippen Calculated Property | |
| logPoct/wat | 2.596 | Crippen Calculated Property | |
| McVol | 194.940 | ml/mol | McGowan Calculated Property |
| Pc | 2241.88 | kPa | Joback Calculated Property |
| Inp | 1889.00 | NIST | |
| Tboil | 700.64 | K | Joback Calculated Property |
| Tc | 910.00 | K | Joback Calculated Property |
| Tfus | 429.04 | K | Joback Calculated Property |
| Vc | 0.741 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [516.26; 585.94] | J/mol×K | [700.64; 910.00] | 
|
| Cp,gas | 516.26 | J/mol×K | 700.64 | Joback Calculated Property |
| Cp,gas | 530.06 | J/mol×K | 735.53 | Joback Calculated Property |
| Cp,gas | 542.96 | J/mol×K | 770.43 | Joback Calculated Property |
| Cp,gas | 554.99 | J/mol×K | 805.32 | Joback Calculated Property |
| Cp,gas | 566.16 | J/mol×K | 840.21 | Joback Calculated Property |
| Cp,gas | 576.47 | J/mol×K | 875.11 | Joback Calculated Property |
| Cp,gas | 585.94 | J/mol×K | 910.00 | Joback Calculated Property |
| η | [0.0001255; 0.0009868] | Pa×s | [429.04; 700.64] |
|
| η | 0.0009868 | Pa×s | 429.04 | Joback Calculated Property |
| η | 0.0005940 | Pa×s | 474.31 | Joback Calculated Property |
| η | 0.0003906 | Pa×s | 519.57 | Joback Calculated Property |
| η | 0.0002747 | Pa×s | 564.84 | Joback Calculated Property |
| η | 0.0002035 | Pa×s | 610.11 | Joback Calculated Property |
| η | 0.0001572 | Pa×s | 655.37 | Joback Calculated Property |
| η | 0.0001255 | Pa×s | 700.64 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Terephthalic acid, but-3-enyl ethyl ester.
Sources
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