- InChI
- InChI=1S/C17H21ClO4/c1-2-3-4-5-12-21-16(19)10-7-11-17(20)22-15-9-6-8-14(18)13-15/h2-3,6,8-9,13H,4-5,7,10-12H2,1H3/b3-2+
- InChI Key
- HWKPURINCFHHTK-NSCUHMNNSA-N
- Formula
- C17H21ClO4
- SMILES
-
CC=CCCCOC(=O)CCCC(=O)Oc1cccc(C
l)c1 - Molecular Weight1
- 324.80
- 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° | -204.51 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -557.27 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 43.41 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.03 | kJ/mol | Joback Calculated Property |
| log10WS | -4.95 | Crippen Calculated Property | |
| logPoct/wat | 4.315 | Crippen Calculated Property | |
| McVol | 249.450 | ml/mol | McGowan Calculated Property |
| Pc | 1697.70 | kPa | Joback Calculated Property |
| Inp | [2348.00; 2348.00] |
|
|
| Inp | 2348.00 | NIST | |
| Inp | 2348.00 | NIST | |
| Tboil | 814.19 | K | Joback Calculated Property |
| Tc | 1024.15 | K | Joback Calculated Property |
| Tfus | 489.45 | K | Joback Calculated Property |
| Vc | 0.957 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [705.27; 773.76] | J/mol×K | [814.19; 1024.15] |
|
| Cp,gas | 705.27 | J/mol×K | 814.19 | Joback Calculated Property |
| Cp,gas | 719.05 | J/mol×K | 849.18 | Joback Calculated Property |
| Cp,gas | 731.84 | J/mol×K | 884.18 | Joback Calculated Property |
| Cp,gas | 743.68 | J/mol×K | 919.17 | Joback Calculated Property |
| Cp,gas | 754.59 | J/mol×K | 954.16 | Joback Calculated Property |
| Cp,gas | 764.61 | J/mol×K | 989.16 | Joback Calculated Property |
| Cp,gas | 773.76 | J/mol×K | 1024.15 | Joback Calculated Property |
| η | [0.0000629; 0.0006045] | Pa×s | [489.45; 814.19] |
|
| η | 0.0006045 | Pa×s | 489.45 | Joback Calculated Property |
| η | 0.0003435 | Pa×s | 543.57 | Joback Calculated Property |
| η | 0.0002163 | Pa×s | 597.70 | Joback Calculated Property |
| η | 0.0001471 | Pa×s | 651.82 | Joback Calculated Property |
| η | 0.0001061 | Pa×s | 705.94 | Joback Calculated Property |
| η | 0.0000802 | Pa×s | 760.07 | Joback Calculated Property |
| η | 0.0000629 | Pa×s | 814.19 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, hex-4-en-1-yl 3-chlorophenyl ester.
Sources
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