- InChI
- InChI=1S/C11H18O5/c1-3-15-10(13)7-5-9(12)6-8-11(14)16-4-2/h3-8H2,1-2H3
- InChI Key
- ZGBUXZJMZBBISR-UHFFFAOYSA-N
- Formula
- C11H18O5
- SMILES
- CCOC(=O)CCC(=O)CCC(=O)OCC
- Molecular Weight1
- 230.26
- CAS
- 6317-49-3
- Other Names
-
- Diethyl «gamma»-ketopimelate
- Heptanedioic acid, 4-oxo-, diethyl ester
- 4-Oxoheptanedioic acid, diethyl ester
- diethyl 4-oxoheptanedioate
- 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).
- 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° | -555.02 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -872.55 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 31.42 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.14 | kJ/mol | Joback Calculated Property |
| log10WS | -1.43 | Crippen Calculated Property | |
| logPoct/wat | 1.242 | Crippen Calculated Property | |
| McVol | 182.300 | ml/mol | McGowan Calculated Property |
| Pc | 2227.09 | kPa | Joback Calculated Property |
| Tboil | 657.53 | K | Joback Calculated Property |
| Tc | 843.59 | K | Joback Calculated Property |
| Tfus | 407.98 | K | Joback Calculated Property |
| Vc | 0.706 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [484.24; 552.05] | J/mol×K | [657.53; 843.59] | 
|
| Cp,gas | 484.24 | J/mol×K | 657.53 | Joback Calculated Property |
| Cp,gas | 497.14 | J/mol×K | 688.54 | Joback Calculated Property |
| Cp,gas | 509.41 | J/mol×K | 719.55 | Joback Calculated Property |
| Cp,gas | 521.04 | J/mol×K | 750.56 | Joback Calculated Property |
| Cp,gas | 532.02 | J/mol×K | 781.57 | Joback Calculated Property |
| Cp,gas | 542.36 | J/mol×K | 812.58 | Joback Calculated Property |
| Cp,gas | 552.05 | J/mol×K | 843.59 | Joback Calculated Property |
| η | [0.0001708; 0.0014910] | Pa×s | [407.98; 657.53] |
|
| η | 0.0014910 | Pa×s | 407.98 | Joback Calculated Property |
| η | 0.0008793 | Pa×s | 449.57 | Joback Calculated Property |
| η | 0.0005670 | Pa×s | 491.16 | Joback Calculated Property |
| η | 0.0003916 | Pa×s | 532.75 | Joback Calculated Property |
| η | 0.0002853 | Pa×s | 574.35 | Joback Calculated Property |
| η | 0.0002170 | Pa×s | 615.94 | Joback Calculated Property |
| η | 0.0001708 | Pa×s | 657.53 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethyl 4-oxopimelate.
Sources
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