- InChI
- InChI=1S/C17H17Cl3O4/c1-3-6-12(4-2)23-15(21)7-5-8-16(22)24-17-13(19)9-11(18)10-14(17)20/h3-4,9-10,12H,1-2,5-8H2
- InChI Key
- KTMCAEBJFPYSCZ-UHFFFAOYSA-N
- Formula
- C17H17Cl3O4
- SMILES
-
C=CCC(C=C)OC(=O)CCCC(=O)Oc1c(C
l)cc(Cl)cc1Cl - Molecular Weight1
- 391.67
- 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° | -154.61 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -483.33 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 44.74 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.44 | kJ/mol | Joback Calculated Property |
| log10WS | -6.29 | Crippen Calculated Property | |
| logPoct/wat | 5.396 | Crippen Calculated Property | |
| McVol | 269.630 | ml/mol | McGowan Calculated Property |
| Pc | 1611.58 | kPa | Joback Calculated Property |
| Inp | [2462.00; 2462.00] |
|
|
| Inp | 2462.00 | NIST | |
| Inp | 2462.00 | NIST | |
| Tboil | 887.77 | K | Joback Calculated Property |
| Tc | 1108.91 | K | Joback Calculated Property |
| Tfus | 560.89 | K | Joback Calculated Property |
| Vc | 1.030 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [721.91; 772.82] | J/mol×K | [887.77; 1108.91] |
|
| Cp,gas | 721.91 | J/mol×K | 887.77 | Joback Calculated Property |
| Cp,gas | 732.85 | J/mol×K | 924.63 | Joback Calculated Property |
| Cp,gas | 742.78 | J/mol×K | 961.48 | Joback Calculated Property |
| Cp,gas | 751.71 | J/mol×K | 998.34 | Joback Calculated Property |
| Cp,gas | 759.69 | J/mol×K | 1035.20 | Joback Calculated Property |
| Cp,gas | 766.71 | J/mol×K | 1072.06 | Joback Calculated Property |
| Cp,gas | 772.82 | J/mol×K | 1108.91 | Joback Calculated Property |
| η | [0.0000582; 0.0004036] | Pa×s | [560.89; 887.77] |
|
| η | 0.0004036 | Pa×s | 560.89 | Joback Calculated Property |
| η | 0.0002534 | Pa×s | 615.37 | Joback Calculated Property |
| η | 0.0001716 | Pa×s | 669.85 | Joback Calculated Property |
| η | 0.0001232 | Pa×s | 724.33 | Joback Calculated Property |
| η | 0.0000927 | Pa×s | 778.81 | Joback Calculated Property |
| η | 0.0000724 | Pa×s | 833.29 | Joback Calculated Property |
| η | 0.0000582 | Pa×s | 887.77 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, hexa-1,5-dien-3-yl 2,4,6-trichlorophenyl ester.
Sources
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