- InChI
- InChI=1S/C14H17IO4/c1-2-9-18-13(16)7-8-14(17)19-10-11-5-3-4-6-12(11)15/h3-6H,2,7-10H2,1H3
- InChI Key
- QFTNVTYTHQFNTG-UHFFFAOYSA-N
- Formula
- C14H17IO4
- SMILES
- CCCOC(=O)CCC(=O)OCc1ccccc1I
- Molecular Weight1
- 376.19
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.7250 | Relay (1.0) Calculated Property | |
| ΔfG° | -239.94 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -610.38 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 35.65 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 89.70 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.46 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.28 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.068 | Crippen Calculated Property | |
| McVol | 225.060 | ml/mol | McGowan Calculated Property |
| Pc | 2111.94 | kPa | Joback Calculated Property |
| Inp | [2241.00; 2241.00] |
|
|
| Inp | 2241.00 | NIST | |
| Inp | 2241.00 | NIST | |
| Tboil | 636.57 | K | Relay (1.0) Calculated Property |
| Tc | 831.77 | K | Relay (1.0) Calculated Property |
| Tfus | 303.45 | K | Relay (1.0) Calculated Property |
| Vc | 0.798 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [588.17; 649.09] | J/mol×K | [797.10; 1024.09] |
|
| Cp,gas | 588.17 | J/mol×K | 797.10 | Joback Calculated Property |
| Cp,gas | 600.78 | J/mol×K | 834.93 | Joback Calculated Property |
| Cp,gas | 612.37 | J/mol×K | 872.76 | Joback Calculated Property |
| Cp,gas | 622.98 | J/mol×K | 910.59 | Joback Calculated Property |
| Cp,gas | 632.62 | J/mol×K | 948.43 | Joback Calculated Property |
| Cp,gas | 641.32 | J/mol×K | 986.26 | Joback Calculated Property |
| Cp,gas | 649.09 | J/mol×K | 1024.09 | Joback Calculated Property |
| η | [0.0000937; 0.0007951] | Pa×s | [488.86; 797.10] |
|
| η | 0.0007951 | Pa×s | 488.86 | Joback Calculated Property |
| η | 0.0004700 | Pa×s | 540.23 | Joback Calculated Property |
| η | 0.0003044 | Pa×s | 591.61 | Joback Calculated Property |
| η | 0.0002113 | Pa×s | 642.98 | Joback Calculated Property |
| η | 0.0001548 | Pa×s | 694.35 | Joback Calculated Property |
| η | 0.0001184 | Pa×s | 745.73 | Joback Calculated Property |
| η | 0.0000937 | Pa×s | 797.10 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 2-iodobenzyl propyl ester.
Sources
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