- InChI
- InChI=1S/C18H25IO4/c1-4-5-16(13(2)3)23-18(21)11-10-17(20)22-12-14-6-8-15(19)9-7-14/h6-9,13,16H,4-5,10-12H2,1-3H3
- InChI Key
- HUMOIHSHRDDJRX-UHFFFAOYSA-N
- Formula
- C18H25IO4
- SMILES
-
CCCC(OC(=O)CCC(=O)OCc1ccc(I)cc
1)C(C)C - Molecular Weight1
- 432.29
- 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° | -211.14 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -613.08 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 38.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.51 | kJ/mol | Joback Calculated Property |
| log10WS | -5.70 | Crippen Calculated Property | |
| logPoct/wat | 4.483 | Crippen Calculated Property | |
| McVol | 281.420 | ml/mol | McGowan Calculated Property |
| Pc | 1545.13 | kPa | Joback Calculated Property |
| Inp | [2521.00; 2521.00] |
|
|
| Inp | 2521.00 | NIST | |
| Inp | 2521.00 | NIST | |
| Tboil | 887.74 | K | Joback Calculated Property |
| Tc | 1111.68 | K | Joback Calculated Property |
| Tfus | 503.94 | K | Joback Calculated Property |
| Vc | 1.060 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [813.61; 879.47] | J/mol×K | [887.74; 1111.68] |
|
| Cp,gas | 813.61 | J/mol×K | 887.74 | Joback Calculated Property |
| Cp,gas | 827.46 | J/mol×K | 925.06 | Joback Calculated Property |
| Cp,gas | 840.11 | J/mol×K | 962.39 | Joback Calculated Property |
| Cp,gas | 851.60 | J/mol×K | 999.71 | Joback Calculated Property |
| Cp,gas | 861.97 | J/mol×K | 1037.04 | Joback Calculated Property |
| Cp,gas | 871.24 | J/mol×K | 1074.36 | Joback Calculated Property |
| Cp,gas | 879.47 | J/mol×K | 1111.68 | Joback Calculated Property |
| η | [0.0000438; 0.0006556] | Pa×s | [503.94; 887.74] |
|
| η | 0.0006556 | Pa×s | 503.94 | Joback Calculated Property |
| η | 0.0003239 | Pa×s | 567.91 | Joback Calculated Property |
| η | 0.0001845 | Pa×s | 631.87 | Joback Calculated Property |
| η | 0.0001166 | Pa×s | 695.84 | Joback Calculated Property |
| η | 0.0000796 | Pa×s | 759.81 | Joback Calculated Property |
| η | 0.0000577 | Pa×s | 823.77 | Joback Calculated Property |
| η | 0.0000438 | Pa×s | 887.74 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 4-iodobenzyl 2-methylhex-3-yl ester.
Sources
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