- InChI
- InChI=1S/C15H19ClO4/c1-3-19-14(17)6-4-5-7-15(18)20-13-10-11(2)8-9-12(13)16/h8-10H,3-7H2,1-2H3
- InChI Key
- KBSHCVCALKHYFO-UHFFFAOYSA-N
- Formula
- C15H19ClO4
- SMILES
-
CCOC(=O)CCCCC(=O)Oc1cc(C)ccc1C
l - Molecular Weight1
- 298.76
- 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° | -311.20 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -644.68 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.28 | kJ/mol | Joback Calculated Property |
| log10WS | -4.32 | Crippen Calculated Property | |
| logPoct/wat | 3.677 | Crippen Calculated Property | |
| McVol | 225.570 | ml/mol | McGowan Calculated Property |
| Pc | 1887.08 | kPa | Joback Calculated Property |
| Inp | [2128.00; 2128.00] |
|
|
| Inp | 2128.00 | NIST | |
| Inp | 2128.00 | NIST | |
| Tboil | 769.25 | K | Joback Calculated Property |
| Tc | 977.26 | K | Joback Calculated Property |
| Tfus | 484.51 | K | Joback Calculated Property |
| Vc | 0.865 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [618.97; 686.52] | J/mol×K | [769.25; 977.26] |
|
| Cp,gas | 618.97 | J/mol×K | 769.25 | Joback Calculated Property |
| Cp,gas | 632.56 | J/mol×K | 803.92 | Joback Calculated Property |
| Cp,gas | 645.21 | J/mol×K | 838.59 | Joback Calculated Property |
| Cp,gas | 656.93 | J/mol×K | 873.25 | Joback Calculated Property |
| Cp,gas | 667.71 | J/mol×K | 907.92 | Joback Calculated Property |
| Cp,gas | 677.58 | J/mol×K | 942.59 | Joback Calculated Property |
| Cp,gas | 686.52 | J/mol×K | 977.26 | Joback Calculated Property |
| η | [0.0000950; 0.0006726] | Pa×s | [484.51; 769.25] |
|
| η | 0.0006726 | Pa×s | 484.51 | Joback Calculated Property |
| η | 0.0004197 | Pa×s | 531.97 | Joback Calculated Property |
| η | 0.0002829 | Pa×s | 579.42 | Joback Calculated Property |
| η | 0.0002024 | Pa×s | 626.88 | Joback Calculated Property |
| η | 0.0001519 | Pa×s | 674.34 | Joback Calculated Property |
| η | 0.0001183 | Pa×s | 721.79 | Joback Calculated Property |
| η | 0.0000950 | Pa×s | 769.25 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Adipic acid, 2-chloro-5-methylphenyl ethyl ester.
Sources
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