- InChI
- InChI=1S/C20H29ClO4/c1-4-6-7-9-16(5-2)24-19(22)10-8-11-20(23)25-17-12-13-18(21)15(3)14-17/h12-14,16H,4-11H2,1-3H3
- InChI Key
- CAUNHLZGPYTOEW-UHFFFAOYSA-N
- Formula
- C20H29ClO4
- SMILES
-
CCCCCC(CC)OC(=O)CCCC(=O)Oc1ccc
(Cl)c(C)c1 - Molecular Weight1
- 368.89
- 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° | -271.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -753.16 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 47.07 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 86.02 | kJ/mol | Joback Calculated Property |
| log10WS | -6.52 | Crippen Calculated Property | |
| logPoct/wat | 5.626 | Crippen Calculated Property | |
| McVol | 296.020 | ml/mol | McGowan Calculated Property |
| Pc | 1299.53 | kPa | Joback Calculated Property |
| Inp | [2517.00; 2517.00] |
|
|
| Inp | 2517.00 | NIST | |
| Inp | 2517.00 | NIST | |
| Tboil | 883.21 | K | Joback Calculated Property |
| Tc | 1090.95 | K | Joback Calculated Property |
| Tfus | 525.86 | K | Joback Calculated Property |
| Vc | 1.139 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [904.62; 977.00] | J/mol×K | [883.21; 1090.95] |
|
| Cp,gas | 904.62 | J/mol×K | 883.21 | Joback Calculated Property |
| Cp,gas | 919.59 | J/mol×K | 917.83 | Joback Calculated Property |
| Cp,gas | 933.37 | J/mol×K | 952.46 | Joback Calculated Property |
| Cp,gas | 945.98 | J/mol×K | 987.08 | Joback Calculated Property |
| Cp,gas | 957.44 | J/mol×K | 1021.70 | Joback Calculated Property |
| Cp,gas | 967.77 | J/mol×K | 1056.32 | Joback Calculated Property |
| Cp,gas | 977.00 | J/mol×K | 1090.95 | Joback Calculated Property |
| η | [0.0000439; 0.0004662] | Pa×s | [525.86; 883.21] |
|
| η | 0.0004662 | Pa×s | 525.86 | Joback Calculated Property |
| η | 0.0002574 | Pa×s | 585.42 | Joback Calculated Property |
| η | 0.0001586 | Pa×s | 644.98 | Joback Calculated Property |
| η | 0.0001060 | Pa×s | 704.54 | Joback Calculated Property |
| η | 0.0000755 | Pa×s | 764.09 | Joback Calculated Property |
| η | 0.0000565 | Pa×s | 823.65 | Joback Calculated Property |
| η | 0.0000439 | Pa×s | 883.21 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 4-chloro-3-methylphenyl 3-octyl ester.
Sources
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