- InChI
- InChI=1S/C18H33ClO4/c1-15(2)16(3)23-18(21)12-10-11-17(20)22-14-9-7-5-4-6-8-13-19/h15-16H,4-14H2,1-3H3
- InChI Key
- QXMMPSGXYJYUHL-UHFFFAOYSA-N
- Formula
- C18H33ClO4
- SMILES
-
CC(C)C(C)OC(=O)CCCC(=O)OCCCCCC
CCCl - Molecular Weight1
- 348.90
- 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° | -383.97 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -930.75 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 45.10 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.58 | kJ/mol | Joback Calculated Property |
| log10WS | -5.11 | Crippen Calculated Property | |
| logPoct/wat | 4.867 | Crippen Calculated Property | |
| McVol | 291.600 | ml/mol | McGowan Calculated Property |
| Pc | 1209.83 | kPa | Joback Calculated Property |
| Inp | [2361.00; 2361.00] |
|
|
| Inp | 2361.00 | NIST | |
| Inp | 2361.00 | NIST | |
| Tboil | 800.37 | K | Joback Calculated Property |
| Tc | 987.50 | K | Joback Calculated Property |
| Tfus | 436.86 | K | Joback Calculated Property |
| Vc | 1.129 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [882.09; 967.85] | J/mol×K | [800.37; 987.50] |
|
| Cp,gas | 882.09 | J/mol×K | 800.37 | Joback Calculated Property |
| Cp,gas | 898.84 | J/mol×K | 831.56 | Joback Calculated Property |
| Cp,gas | 914.58 | J/mol×K | 862.75 | Joback Calculated Property |
| Cp,gas | 929.34 | J/mol×K | 893.93 | Joback Calculated Property |
| Cp,gas | 943.13 | J/mol×K | 925.12 | Joback Calculated Property |
| Cp,gas | 955.96 | J/mol×K | 956.31 | Joback Calculated Property |
| Cp,gas | 967.85 | J/mol×K | 987.50 | Joback Calculated Property |
| η | [0.0000517; 0.0011551] | Pa×s | [436.86; 800.37] |
|
| η | 0.0011551 | Pa×s | 436.86 | Joback Calculated Property |
| η | 0.0005021 | Pa×s | 497.44 | Joback Calculated Property |
| η | 0.0002615 | Pa×s | 558.03 | Joback Calculated Property |
| η | 0.0001548 | Pa×s | 618.62 | Joback Calculated Property |
| η | 0.0001006 | Pa×s | 679.20 | Joback Calculated Property |
| η | 0.0000701 | Pa×s | 739.79 | Joback Calculated Property |
| η | 0.0000517 | Pa×s | 800.37 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 3-methylbut-2-yl 8-chlorooctyl ester.
Sources
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