- InChI
- InChI=1S/C17H15IO4/c1-2-21-16(19)12-7-9-13(10-8-12)17(20)22-11-14-5-3-4-6-15(14)18/h3-10H,2,11H2,1H3
- InChI Key
- PVJLQXGRZFQJMT-UHFFFAOYSA-N
- Formula
- C17H15IO4
- SMILES
-
CCOC(=O)c1ccc(C(=O)OCc2ccccc2I
)cc1 - Molecular Weight1
- 410.20
- 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° | -111.90 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -356.82 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.07 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.00 | kJ/mol | Joback Calculated Property |
| log10WS | -5.63 | Crippen Calculated Property | |
| logPoct/wat | 3.825 | Crippen Calculated Property | |
| McVol | 243.570 | ml/mol | McGowan Calculated Property |
| Pc | 2167.36 | kPa | Joback Calculated Property |
| Inp | [2856.00; 2856.00] |
|
|
| Inp | 2856.00 | NIST | |
| Inp | 2856.00 | NIST | |
| Tboil | 897.40 | K | Joback Calculated Property |
| Tc | 1150.26 | K | Joback Calculated Property |
| Tfus | 561.61 | K | Joback Calculated Property |
| Vc | 0.907 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [652.28; 701.67] | J/mol×K | [897.40; 1150.26] |
|
| Cp,gas | 652.28 | J/mol×K | 897.40 | Joback Calculated Property |
| Cp,gas | 663.53 | J/mol×K | 939.54 | Joback Calculated Property |
| Cp,gas | 673.50 | J/mol×K | 981.69 | Joback Calculated Property |
| Cp,gas | 682.25 | J/mol×K | 1023.83 | Joback Calculated Property |
| Cp,gas | 689.84 | J/mol×K | 1065.97 | Joback Calculated Property |
| Cp,gas | 696.29 | J/mol×K | 1108.12 | Joback Calculated Property |
| Cp,gas | 701.67 | J/mol×K | 1150.26 | Joback Calculated Property |
| η | [0.0000638; 0.0004608] | Pa×s | [561.61; 897.40] |
|
| η | 0.0004608 | Pa×s | 561.61 | Joback Calculated Property |
| η | 0.0002855 | Pa×s | 617.58 | Joback Calculated Property |
| η | 0.0001915 | Pa×s | 673.54 | Joback Calculated Property |
| η | 0.0001366 | Pa×s | 729.50 | Joback Calculated Property |
| η | 0.0001022 | Pa×s | 785.47 | Joback Calculated Property |
| η | 0.0000795 | Pa×s | 841.43 | Joback Calculated Property |
| η | 0.0000638 | Pa×s | 897.40 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Terephthalic acid, ethyl 2-iodobenzyl ester.
Sources
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