- InChI
- InChI=1S/C16H18Cl2O4/c17-12-7-3-8-13(16(12)18)22-15(20)10-4-9-14(19)21-11-5-1-2-6-11/h3,7-8,11H,1-2,4-6,9-10H2
- InChI Key
- CBNMCNDEPNFZAG-UHFFFAOYSA-N
- Formula
- C16H18Cl2O4
- SMILES
-
O=C(CCCC(=O)OC1CCCC1)Oc1cccc(C
l)c1Cl - Molecular Weight1
- 345.22
- 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° | -278.16 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -620.58 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 38.36 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.15 | kJ/mol | Joback Calculated Property |
| log10WS | -5.37 | Crippen Calculated Property | |
| logPoct/wat | 4.555 | Crippen Calculated Property | |
| McVol | 241.040 | ml/mol | McGowan Calculated Property |
| Pc | 1966.56 | kPa | Joback Calculated Property |
| Inp | [2512.00; 2512.00] |
|
|
| Inp | 2512.00 | NIST | |
| Inp | 2512.00 | NIST | |
| Tboil | 844.84 | K | Joback Calculated Property |
| Tc | 1074.85 | K | Joback Calculated Property |
| Tfus | 536.60 | K | Joback Calculated Property |
| Vc | 0.910 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [688.23; 750.67] | J/mol×K | [844.84; 1074.85] |
|
| Cp,gas | 688.23 | J/mol×K | 844.84 | Joback Calculated Property |
| Cp,gas | 701.69 | J/mol×K | 883.18 | Joback Calculated Property |
| Cp,gas | 713.88 | J/mol×K | 921.51 | Joback Calculated Property |
| Cp,gas | 724.85 | J/mol×K | 959.85 | Joback Calculated Property |
| Cp,gas | 734.62 | J/mol×K | 998.18 | Joback Calculated Property |
| Cp,gas | 743.21 | J/mol×K | 1036.52 | Joback Calculated Property |
| Cp,gas | 750.67 | J/mol×K | 1074.85 | Joback Calculated Property |
| η | [0.0001089; 0.0007008] | Pa×s | [536.60; 844.84] |
|
| η | 0.0007008 | Pa×s | 536.60 | Joback Calculated Property |
| η | 0.0004487 | Pa×s | 587.97 | Joback Calculated Property |
| η | 0.0003086 | Pa×s | 639.35 | Joback Calculated Property |
| η | 0.0002245 | Pa×s | 690.72 | Joback Calculated Property |
| η | 0.0001706 | Pa×s | 742.09 | Joback Calculated Property |
| η | 0.0001343 | Pa×s | 793.47 | Joback Calculated Property |
| η | 0.0001089 | Pa×s | 844.84 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, cyclopentyl 2,3-dichlorophenyl ester.
Sources
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