- InChI
- InChI=1S/C16H20Cl2O4/c1-11(2)9-10-21-14(19)7-4-8-15(20)22-13-6-3-5-12(17)16(13)18/h3,5-6,11H,4,7-10H2,1-2H3
- InChI Key
- QMCOCJADXQXQDH-UHFFFAOYSA-N
- Formula
- C16H20Cl2O4
- SMILES
-
CC(C)CCOC(=O)CCCC(=O)Oc1cccc(C
l)c1Cl - Molecular Weight1
- 347.23
- 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° | -317.15 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -686.34 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 40.90 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.50 | kJ/mol | Joback Calculated Property |
| log10WS | -5.12 | Crippen Calculated Property | |
| logPoct/wat | 4.658 | Crippen Calculated Property | |
| McVol | 251.900 | ml/mol | McGowan Calculated Property |
| Pc | 1697.70 | kPa | Joback Calculated Property |
| Inp | [2392.00; 2392.00] |
|
|
| Inp | 2392.00 | NIST | |
| Inp | 2392.00 | NIST | |
| Tboil | 829.12 | K | Joback Calculated Property |
| Tc | 1042.01 | K | Joback Calculated Property |
| Tfus | 510.70 | K | Joback Calculated Property |
| Vc | 0.964 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [699.46; 761.71] | J/mol×K | [829.12; 1042.01] |
|
| Cp,gas | 699.46 | J/mol×K | 829.12 | Joback Calculated Property |
| Cp,gas | 712.39 | J/mol×K | 864.60 | Joback Calculated Property |
| Cp,gas | 724.28 | J/mol×K | 900.08 | Joback Calculated Property |
| Cp,gas | 735.15 | J/mol×K | 935.56 | Joback Calculated Property |
| Cp,gas | 745.00 | J/mol×K | 971.05 | Joback Calculated Property |
| Cp,gas | 753.85 | J/mol×K | 1006.53 | Joback Calculated Property |
| Cp,gas | 761.71 | J/mol×K | 1042.01 | Joback Calculated Property |
| η | [0.0000669; 0.0005767] | Pa×s | [510.70; 829.12] |
|
| η | 0.0005767 | Pa×s | 510.70 | Joback Calculated Property |
| η | 0.0003401 | Pa×s | 563.77 | Joback Calculated Property |
| η | 0.0002196 | Pa×s | 616.84 | Joback Calculated Property |
| η | 0.0001520 | Pa×s | 669.91 | Joback Calculated Property |
| η | 0.0001111 | Pa×s | 722.98 | Joback Calculated Property |
| η | 0.0000847 | Pa×s | 776.05 | Joback Calculated Property |
| η | 0.0000669 | Pa×s | 829.12 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2,3-dichlorophenyl 3-methylbutyl ester.
Sources
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