- InChI
- InChI=1S/C19H25Cl3O4/c1-3-5-6-8-14(4-2)25-17(23)9-7-10-18(24)26-19-15(21)11-13(20)12-16(19)22/h11-12,14H,3-10H2,1-2H3
- InChI Key
- BUPACMDLMOVBPA-UHFFFAOYSA-N
- Formula
- C19H25Cl3O4
- SMILES
-
CCCCCC(CC)OC(=O)CCCC(=O)Oc1c(C
l)cc(Cl)cc1Cl - Molecular Weight1
- 423.76
- 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° | -313.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -775.47 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 52.48 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 93.23 | kJ/mol | Joback Calculated Property |
| log10WS | -7.42 | Crippen Calculated Property | |
| logPoct/wat | 6.625 | Crippen Calculated Property | |
| McVol | 306.410 | ml/mol | McGowan Calculated Property |
| Pc | 1306.12 | kPa | Joback Calculated Property |
| Inp | [2644.00; 2644.00] |
|
|
| Inp | 2644.00 | NIST | |
| Inp | 2644.00 | NIST | |
| Tboil | 940.17 | K | Joback Calculated Property |
| Tc | 1158.38 | K | Joback Calculated Property |
| Tfus | 586.95 | K | Joback Calculated Property |
| Vc | 1.181 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [892.77; 948.61] | J/mol×K | [940.17; 1158.38] |
|
| Cp,gas | 892.77 | J/mol×K | 940.17 | Joback Calculated Property |
| Cp,gas | 905.03 | J/mol×K | 976.54 | Joback Calculated Property |
| Cp,gas | 916.08 | J/mol×K | 1012.91 | Joback Calculated Property |
| Cp,gas | 925.95 | J/mol×K | 1049.28 | Joback Calculated Property |
| Cp,gas | 934.65 | J/mol×K | 1085.65 | Joback Calculated Property |
| Cp,gas | 942.20 | J/mol×K | 1122.01 | Joback Calculated Property |
| Cp,gas | 948.61 | J/mol×K | 1158.38 | Joback Calculated Property |
| η | [0.0000375; 0.0003038] | Pa×s | [586.95; 940.17] |
|
| η | 0.0003038 | Pa×s | 586.95 | Joback Calculated Property |
| η | 0.0001829 | Pa×s | 645.82 | Joback Calculated Property |
| η | 0.0001199 | Pa×s | 704.69 | Joback Calculated Property |
| η | 0.0000838 | Pa×s | 763.56 | Joback Calculated Property |
| η | 0.0000617 | Pa×s | 822.43 | Joback Calculated Property |
| η | 0.0000473 | Pa×s | 881.30 | Joback Calculated Property |
| η | 0.0000375 | Pa×s | 940.17 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2,4,6-trichlorophenyl 3-octyl ester.
Sources
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