- InChI
- InChI=1S/C16H20Cl2O5/c1-11(2)22-12-6-3-4-7-13(12)23-16(20)9-5-8-15(19)21-10-14(17)18/h3-4,6-7,11,14H,5,8-10H2,1-2H3
- InChI Key
- KRHBCQDDKAIZMB-UHFFFAOYSA-N
- Formula
- C16H20Cl2O5
- SMILES
-
CC(C)Oc1ccccc1OC(=O)CCCC(=O)OC
C(Cl)Cl - Molecular Weight1
- 363.23
- 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° | -414.96 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -812.37 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 38.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.86 | kJ/mol | Joback Calculated Property |
| log10WS | -4.72 | Crippen Calculated Property | |
| logPoct/wat | 3.896 | Crippen Calculated Property | |
| McVol | 257.770 | ml/mol | McGowan Calculated Property |
| Pc | 1706.12 | kPa | Joback Calculated Property |
| Inp | [2384.00; 2384.00] |
|
|
| Inp | 2384.00 | NIST | |
| Inp | 2384.00 | NIST | |
| Tboil | 846.12 | K | Joback Calculated Property |
| Tc | 1060.29 | K | Joback Calculated Property |
| Tfus | 505.41 | K | Joback Calculated Property |
| Vc | 0.976 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [727.93; 786.81] | J/mol×K | [846.12; 1060.29] |
|
| Cp,gas | 727.93 | J/mol×K | 846.12 | Joback Calculated Property |
| Cp,gas | 740.59 | J/mol×K | 881.81 | Joback Calculated Property |
| Cp,gas | 752.11 | J/mol×K | 917.51 | Joback Calculated Property |
| Cp,gas | 762.49 | J/mol×K | 953.20 | Joback Calculated Property |
| Cp,gas | 771.73 | J/mol×K | 988.90 | Joback Calculated Property |
| Cp,gas | 779.84 | J/mol×K | 1024.59 | Joback Calculated Property |
| Cp,gas | 786.81 | J/mol×K | 1060.29 | Joback Calculated Property |
| η | [0.0000453; 0.0005258] | Pa×s | [505.41; 846.12] |
|
| η | 0.0005258 | Pa×s | 505.41 | Joback Calculated Property |
| η | 0.0002843 | Pa×s | 562.20 | Joback Calculated Property |
| η | 0.0001721 | Pa×s | 618.98 | Joback Calculated Property |
| η | 0.0001134 | Pa×s | 675.76 | Joback Calculated Property |
| η | 0.0000797 | Pa×s | 732.55 | Joback Calculated Property |
| η | 0.0000589 | Pa×s | 789.34 | Joback Calculated Property |
| η | 0.0000453 | Pa×s | 846.12 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2,2-dichloroethyl 2-isopropoxyphenyl ester.
Sources
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