- InChI
- InChI=1S/C22H18Cl2O4/c23-18-7-3-8-19(22(18)24)28-21(26)10-4-9-20(25)27-14-15-11-12-16-5-1-2-6-17(16)13-15/h1-3,5-8,11-13H,4,9-10,14H2
- InChI Key
- KDCCOUDDBUOBNV-UHFFFAOYSA-N
- Formula
- C22H18Cl2O4
- SMILES
-
O=C(CCCC(=O)Oc1cccc(Cl)c1Cl)OC
c1ccc2ccccc2c1 - Molecular Weight1
- 417.28
- 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° | -54.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -388.77 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 50.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 99.83 | kJ/mol | Joback Calculated Property |
| log10WS | -7.61 | Crippen Calculated Property | |
| logPoct/wat | 5.966 | Crippen Calculated Property | |
| McVol | 293.220 | ml/mol | McGowan Calculated Property |
| Pc | 1665.97 | kPa | Joback Calculated Property |
| Inp | [3434.00; 3434.00] |
|
|
| Inp | 3434.00 | NIST | |
| Inp | 3434.00 | NIST | |
| Tboil | 1017.48 | K | Joback Calculated Property |
| Tc | 1263.90 | K | Joback Calculated Property |
| Tfus | 664.96 | K | Joback Calculated Property |
| Vc | 1.119 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [853.66; 900.32] | J/mol×K | [1017.48; 1263.90] |
|
| Cp,gas | 853.66 | J/mol×K | 1017.48 | Joback Calculated Property |
| Cp,gas | 863.88 | J/mol×K | 1058.55 | Joback Calculated Property |
| Cp,gas | 873.01 | J/mol×K | 1099.62 | Joback Calculated Property |
| Cp,gas | 881.14 | J/mol×K | 1140.69 | Joback Calculated Property |
| Cp,gas | 888.35 | J/mol×K | 1181.76 | Joback Calculated Property |
| Cp,gas | 894.71 | J/mol×K | 1222.83 | Joback Calculated Property |
| Cp,gas | 900.32 | J/mol×K | 1263.90 | Joback Calculated Property |
| η | [0.0000685; 0.0003404] | Pa×s | [664.96; 1017.48] |
|
| η | 0.0003404 | Pa×s | 664.96 | Joback Calculated Property |
| η | 0.0002338 | Pa×s | 723.71 | Joback Calculated Property |
| η | 0.0001699 | Pa×s | 782.47 | Joback Calculated Property |
| η | 0.0001291 | Pa×s | 841.22 | Joback Calculated Property |
| η | 0.0001017 | Pa×s | 899.97 | Joback Calculated Property |
| η | 0.0000825 | Pa×s | 958.73 | Joback Calculated Property |
| η | 0.0000685 | Pa×s | 1017.48 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2,3-dichlorophenyl (2-naphthyl)methyl ester.
Sources
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