- InChI
- InChI=1S/C21H16Cl2O4/c22-16-9-4-11-18(21(16)23)27-20(25)13-5-12-19(24)26-17-10-3-7-14-6-1-2-8-15(14)17/h1-4,6-11H,5,12-13H2
- InChI Key
- KLEGTRFNGPZTEH-UHFFFAOYSA-N
- Formula
- C21H16Cl2O4
- SMILES
-
O=C(CCCC(=O)Oc1cccc2ccccc12)Oc
1cccc(Cl)c1Cl - Molecular Weight1
- 403.25
- 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° | -63.18 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -368.13 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 48.05 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 97.60 | kJ/mol | Joback Calculated Property |
| log10WS | -7.34 | Crippen Calculated Property | |
| logPoct/wat | 5.828 | Crippen Calculated Property | |
| McVol | 279.130 | ml/mol | McGowan Calculated Property |
| Pc | 1804.63 | kPa | Joback Calculated Property |
| Inp | [3002.00; 3002.00] |
|
|
| Inp | 3002.00 | NIST | |
| Inp | 3002.00 | NIST | |
| Tboil | 994.60 | K | Joback Calculated Property |
| Tc | 1242.36 | K | Joback Calculated Property |
| Tfus | 653.69 | K | Joback Calculated Property |
| Vc | 1.063 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [795.99; 841.50] | J/mol×K | [994.60; 1242.36] |
|
| Cp,gas | 795.99 | J/mol×K | 994.60 | Joback Calculated Property |
| Cp,gas | 806.03 | J/mol×K | 1035.89 | Joback Calculated Property |
| Cp,gas | 814.98 | J/mol×K | 1077.19 | Joback Calculated Property |
| Cp,gas | 822.92 | J/mol×K | 1118.48 | Joback Calculated Property |
| Cp,gas | 829.94 | J/mol×K | 1159.77 | Joback Calculated Property |
| Cp,gas | 836.11 | J/mol×K | 1201.06 | Joback Calculated Property |
| Cp,gas | 841.50 | J/mol×K | 1242.36 | Joback Calculated Property |
| η | [0.0000788; 0.0003764] | Pa×s | [653.69; 994.60] |
|
| η | 0.0003764 | Pa×s | 653.69 | Joback Calculated Property |
| η | 0.0002613 | Pa×s | 710.51 | Joback Calculated Property |
| η | 0.0001915 | Pa×s | 767.33 | Joback Calculated Property |
| η | 0.0001465 | Pa×s | 824.14 | Joback Calculated Property |
| η | 0.0001160 | Pa×s | 880.96 | Joback Calculated Property |
| η | 0.0000945 | Pa×s | 937.78 | Joback Calculated Property |
| η | 0.0000788 | Pa×s | 994.60 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2,3-dichlorophenyl 1-naphthyl ester.
Sources
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