- InChI
- InChI=1S/C16H20Cl2O4/c1-11(2)12-6-3-4-7-13(12)22-16(20)9-5-8-15(19)21-10-14(17)18/h3-4,6-7,11,14H,5,8-10H2,1-2H3
- InChI Key
- UAOBRRMQORHYBP-UHFFFAOYSA-N
- Formula
- C16H20Cl2O4
- SMILES
-
CC(C)c1ccccc1OC(=O)CCCC(=O)OCC
(Cl)Cl - Molecular Weight1
- 347.23
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.8152 | Relay (1.0) Calculated Property | |
| ΔfG° | -309.96 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -790.18 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 37.77 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 96.84 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.81 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.67 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.233 | Crippen Calculated Property | |
| McVol | 251.900 | ml/mol | McGowan Calculated Property |
| Pc | 1730.34 | kPa | Joback Calculated Property |
| Inp | [2296.00; 2296.00] |
|
|
| Inp | 2296.00 | NIST | |
| Inp | 2296.00 | NIST | |
| Tboil | 620.76 | K | Relay (1.0) Calculated Property |
| Tc | 847.19 | K | Relay (1.0) Calculated Property |
| Tfus | 325.97 | K | Relay (1.0) Calculated Property |
| Vc | 0.895 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [701.26; 764.50] | J/mol×K | [823.70; 1038.56] |
|
| Cp,gas | 701.26 | J/mol×K | 823.70 | Joback Calculated Property |
| Cp,gas | 714.43 | J/mol×K | 859.51 | Joback Calculated Property |
| Cp,gas | 726.52 | J/mol×K | 895.32 | Joback Calculated Property |
| Cp,gas | 737.56 | J/mol×K | 931.13 | Joback Calculated Property |
| Cp,gas | 747.55 | J/mol×K | 966.94 | Joback Calculated Property |
| Cp,gas | 756.53 | J/mol×K | 1002.75 | Joback Calculated Property |
| Cp,gas | 764.50 | J/mol×K | 1038.56 | Joback Calculated Property |
| η | [0.0000607; 0.0007599] | Pa×s | [483.18; 823.70] |
|
| η | 0.0007599 | Pa×s | 483.18 | Joback Calculated Property |
| η | 0.0003996 | Pa×s | 539.93 | Joback Calculated Property |
| η | 0.0002375 | Pa×s | 596.69 | Joback Calculated Property |
| η | 0.0001545 | Pa×s | 653.44 | Joback Calculated Property |
| η | 0.0001077 | Pa×s | 710.19 | Joback Calculated Property |
| η | 0.0000791 | Pa×s | 766.95 | Joback Calculated Property |
| η | 0.0000607 | Pa×s | 823.70 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2,2-dichloroethyl 2-isopropylphenyl ester.
Sources
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