- InChI
- InChI=1S/C14H21Cl3O4/c15-11-5-2-1-4-10(11)8-20-13(18)6-3-7-14(19)21-9-12(16)17/h10-12H,1-9H2
- InChI Key
- NHIGIWVVKZYBCS-UHFFFAOYSA-N
- Formula
- C14H21Cl3O4
- SMILES
-
O=C(CCCC(=O)OCC1CCCCC1Cl)OCC(C
l)Cl - Molecular Weight1
- 359.67
- 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° | -422.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -840.41 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 39.56 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.96 | kJ/mol | Joback Calculated Property |
| log10WS | -4.24 | Crippen Calculated Property | |
| logPoct/wat | 3.844 | Crippen Calculated Property | |
| McVol | 248.860 | ml/mol | McGowan Calculated Property |
| Pc | 1734.67 | kPa | Joback Calculated Property |
| Inp | [2431.00; 2431.00] |
|
|
| Inp | 2431.00 | NIST | |
| Inp | 2431.00 | NIST | |
| Tboil | 799.03 | K | Joback Calculated Property |
| Tc | 1012.43 | K | Joback Calculated Property |
| Tfus | 469.76 | K | Joback Calculated Property |
| Vc | 0.941 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [705.89; 776.68] | J/mol×K | [799.03; 1012.43] |
|
| Cp,gas | 705.89 | J/mol×K | 799.03 | Joback Calculated Property |
| Cp,gas | 720.68 | J/mol×K | 834.60 | Joback Calculated Property |
| Cp,gas | 734.27 | J/mol×K | 870.16 | Joback Calculated Property |
| Cp,gas | 746.65 | J/mol×K | 905.73 | Joback Calculated Property |
| Cp,gas | 757.84 | J/mol×K | 941.30 | Joback Calculated Property |
| Cp,gas | 767.85 | J/mol×K | 976.87 | Joback Calculated Property |
| Cp,gas | 776.68 | J/mol×K | 1012.43 | Joback Calculated Property |
| η | [0.0000978; 0.0011341] | Pa×s | [469.76; 799.03] |
|
| η | 0.0011341 | Pa×s | 469.76 | Joback Calculated Property |
| η | 0.0006088 | Pa×s | 524.64 | Joback Calculated Property |
| η | 0.0003677 | Pa×s | 579.52 | Joback Calculated Property |
| η | 0.0002423 | Pa×s | 634.39 | Joback Calculated Property |
| η | 0.0001707 | Pa×s | 689.27 | Joback Calculated Property |
| η | 0.0001266 | Pa×s | 744.15 | Joback Calculated Property |
| η | 0.0000978 | Pa×s | 799.03 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, (2-chlorocyclohexyl)methyl 2,2-dichloroethyl ester.
Sources
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