- InChI
- InChI=1S/C18H17ClO5/c1-22-15-7-5-13(6-8-15)12-23-17(20)9-10-18(21)24-16-4-2-3-14(19)11-16/h2-8,11H,9-10,12H2,1H3
- InChI Key
- BGOBLKRUBZZPLL-UHFFFAOYSA-N
- Formula
- C18H17ClO5
- SMILES
-
COc1ccc(COC(=O)CCC(=O)Oc2cccc(
Cl)c2)cc1 - Molecular Weight1
- 348.78
- 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° | -278.53 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -602.29 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 40.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 86.65 | kJ/mol | Joback Calculated Property |
| log10WS | -4.82 | Crippen Calculated Property | |
| logPoct/wat | 3.778 | Crippen Calculated Property | |
| McVol | 249.950 | ml/mol | McGowan Calculated Property |
| Pc | 1930.44 | kPa | Joback Calculated Property |
| Inp | [2776.00; 2776.00] |
|
|
| Inp | 2776.00 | NIST | |
| Inp | 2776.00 | NIST | |
| Tboil | 886.99 | K | Joback Calculated Property |
| Tc | 1117.53 | K | Joback Calculated Property |
| Tfus | 566.97 | K | Joback Calculated Property |
| Vc | 0.943 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [715.76; 766.80] | J/mol×K | [886.99; 1117.53] |
|
| Cp,gas | 715.76 | J/mol×K | 886.99 | Joback Calculated Property |
| Cp,gas | 727.55 | J/mol×K | 925.41 | Joback Calculated Property |
| Cp,gas | 738.00 | J/mol×K | 963.84 | Joback Calculated Property |
| Cp,gas | 747.15 | J/mol×K | 1002.26 | Joback Calculated Property |
| Cp,gas | 754.98 | J/mol×K | 1040.69 | Joback Calculated Property |
| Cp,gas | 761.53 | J/mol×K | 1079.11 | Joback Calculated Property |
| Cp,gas | 766.80 | J/mol×K | 1117.53 | Joback Calculated Property |
| η | [0.0000491; 0.0003311] | Pa×s | [566.97; 886.99] |
|
| η | 0.0003311 | Pa×s | 566.97 | Joback Calculated Property |
| η | 0.0002101 | Pa×s | 620.31 | Joback Calculated Property |
| η | 0.0001433 | Pa×s | 673.64 | Joback Calculated Property |
| η | 0.0001033 | Pa×s | 726.98 | Joback Calculated Property |
| η | 0.0000779 | Pa×s | 780.32 | Joback Calculated Property |
| η | 0.0000610 | Pa×s | 833.65 | Joback Calculated Property |
| η | 0.0000491 | Pa×s | 886.99 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 3-chlorophenyl 4-methoxybenzyl ester.
Sources
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