- InChI
- InChI=1S/C16H19Cl3O4/c1-2-3-4-8-22-15(20)6-5-7-16(21)23-14-10-12(18)11(17)9-13(14)19/h9-10H,2-8H2,1H3
- InChI Key
- XTOBBTRUDWCLJZ-UHFFFAOYSA-N
- Formula
- C16H19Cl3O4
- SMILES
-
CCCCCOC(=O)CCCC(=O)Oc1cc(Cl)c(
Cl)cc1Cl - Molecular Weight1
- 381.68
- 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° | -336.27 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -708.27 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 48.23 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 86.94 | kJ/mol | Joback Calculated Property |
| log10WS | -6.05 | Crippen Calculated Property | |
| logPoct/wat | 5.456 | Crippen Calculated Property | |
| McVol | 264.140 | ml/mol | McGowan Calculated Property |
| Pc | 1616.77 | kPa | Joback Calculated Property |
| Inp | 2601.00 | NIST | |
| Tboil | 871.97 | K | Joback Calculated Property |
| Tc | 1087.15 | K | Joback Calculated Property |
| Tfus | 568.14 | K | Joback Calculated Property |
| Vc | 1.018 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [720.38; 774.56] | J/mol×K | [871.97; 1087.15] | 
|
| Cp,gas | 720.38 | J/mol×K | 871.97 | Joback Calculated Property |
| Cp,gas | 731.95 | J/mol×K | 907.83 | Joback Calculated Property |
| Cp,gas | 742.49 | J/mol×K | 943.70 | Joback Calculated Property |
| Cp,gas | 752.01 | J/mol×K | 979.56 | Joback Calculated Property |
| Cp,gas | 760.53 | J/mol×K | 1015.42 | Joback Calculated Property |
| Cp,gas | 768.04 | J/mol×K | 1051.29 | Joback Calculated Property |
| Cp,gas | 774.56 | J/mol×K | 1087.15 | Joback Calculated Property |
| η | [0.0000638; 0.0003890] | Pa×s | [568.14; 871.97] |
|
| η | 0.0003890 | Pa×s | 568.14 | Joback Calculated Property |
| η | 0.0002544 | Pa×s | 618.78 | Joback Calculated Property |
| η | 0.0001774 | Pa×s | 669.42 | Joback Calculated Property |
| η | 0.0001302 | Pa×s | 720.05 | Joback Calculated Property |
| η | 0.0000995 | Pa×s | 770.69 | Joback Calculated Property |
| η | 0.0000786 | Pa×s | 821.33 | Joback Calculated Property |
| η | 0.0000638 | Pa×s | 871.97 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, pentyl 2,4,5-trichlorophenyl ester.
Sources
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