- InChI
- InChI=1S/C18H25ClO5/c1-14(9-11-22-2)10-12-23-17(20)7-4-8-18(21)24-16-6-3-5-15(19)13-16/h3,5-6,13-14H,4,7-12H2,1-2H3
- InChI Key
- DNCIVNUWRDWISI-UHFFFAOYSA-N
- Formula
- C18H25ClO5
- SMILES
-
COCCC(C)CCOC(=O)CCCC(=O)Oc1ccc
c(Cl)c1 - Molecular Weight1
- 356.84
- 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° | -383.75 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -832.63 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 43.46 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.32 | kJ/mol | Joback Calculated Property |
| log10WS | -4.36 | Crippen Calculated Property | |
| logPoct/wat | 4.022 | Crippen Calculated Property | |
| McVol | 273.710 | ml/mol | McGowan Calculated Property |
| Pc | 1497.67 | kPa | Joback Calculated Property |
| Inp | [2504.00; 2504.00] |
|
|
| Inp | 2504.00 | NIST | |
| Inp | 2504.00 | NIST | |
| Tboil | 854.89 | K | Joback Calculated Property |
| Tc | 1061.59 | K | Joback Calculated Property |
| Tfus | 513.03 | K | Joback Calculated Property |
| Vc | 1.044 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [816.98; 884.53] | J/mol×K | [854.89; 1061.59] |
|
| Cp,gas | 816.98 | J/mol×K | 854.89 | Joback Calculated Property |
| Cp,gas | 831.15 | J/mol×K | 889.34 | Joback Calculated Property |
| Cp,gas | 844.14 | J/mol×K | 923.79 | Joback Calculated Property |
| Cp,gas | 855.96 | J/mol×K | 958.24 | Joback Calculated Property |
| Cp,gas | 866.63 | J/mol×K | 992.69 | Joback Calculated Property |
| Cp,gas | 876.15 | J/mol×K | 1027.14 | Joback Calculated Property |
| Cp,gas | 884.53 | J/mol×K | 1061.59 | Joback Calculated Property |
| η | [0.0000432; 0.0004669] | Pa×s | [513.03; 854.89] |
|
| η | 0.0004669 | Pa×s | 513.03 | Joback Calculated Property |
| η | 0.0002575 | Pa×s | 570.01 | Joback Calculated Property |
| η | 0.0001582 | Pa×s | 626.98 | Joback Calculated Property |
| η | 0.0001054 | Pa×s | 683.96 | Joback Calculated Property |
| η | 0.0000748 | Pa×s | 740.94 | Joback Calculated Property |
| η | 0.0000557 | Pa×s | 797.91 | Joback Calculated Property |
| η | 0.0000432 | Pa×s | 854.89 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 3-chlorophenyl 3-methyl-5-methoxypentyl ester.
Sources
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