- InChI
- InChI=1S/C7H10O5/c8-5(1-3-6(9)10)2-4-7(11)12/h1-4H2,(H,9,10)(H,11,12)
- InChI Key
- UDDSEESQRGPVIL-UHFFFAOYSA-N
- Formula
- C7H10O5
- SMILES
- O=C(O)CCC(=O)CCC(=O)O
- Molecular Weight1
- 174.15
- CAS
- 502-50-1
- Other Names
-
- «gamma»-Ketopimelic acid
- Heptanedioic acid, 4-oxo-
- 4-Oxoheptanedioic acid
- 4-Oxopimelic acid
- 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).
- 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 | 0.8813 | Relay (1.0) Calculated Property | |
| ΔfG° | -808.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -966.89 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 35.77 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 114.84 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.93 | eV | Relay (1.0) Calculated Property |
| log10WS | 0.06 | Relay (1.0) Calculated Property | |
| logPoct/wat | 0.285 | Crippen Calculated Property | |
| McVol | 125.940 | ml/mol | McGowan Calculated Property |
| Pc | 3677.55 | kPa | Joback Calculated Property |
| Tboil | 549.38 | K | Relay (1.0) Calculated Property |
| Tc | 785.75 | K | Relay (1.0) Calculated Property |
| Tfus | 445.61 | K | Relay (1.0) Calculated Property |
| Vc | 0.464 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [337.80; 378.36] | J/mol×K | [704.65; 912.27] | 
|
| Cp,gas | 337.80 | J/mol×K | 704.65 | Joback Calculated Property |
| Cp,gas | 345.78 | J/mol×K | 739.25 | Joback Calculated Property |
| Cp,gas | 353.23 | J/mol×K | 773.86 | Joback Calculated Property |
| Cp,gas | 360.18 | J/mol×K | 808.46 | Joback Calculated Property |
| Cp,gas | 366.67 | J/mol×K | 843.06 | Joback Calculated Property |
| Cp,gas | 372.72 | J/mol×K | 877.67 | Joback Calculated Property |
| Cp,gas | 378.36 | J/mol×K | 912.27 | Joback Calculated Property |
| η | [0.0002169; 0.0007154] | Pa×s | [539.78; 704.65] |
|
| η | 0.0007154 | Pa×s | 539.78 | Joback Calculated Property |
| η | 0.0005588 | Pa×s | 567.26 | Joback Calculated Property |
| η | 0.0004465 | Pa×s | 594.74 | Joback Calculated Property |
| η | 0.0003639 | Pa×s | 622.21 | Joback Calculated Property |
| η | 0.0003018 | Pa×s | 649.69 | Joback Calculated Property |
| η | 0.0002541 | Pa×s | 677.17 | Joback Calculated Property |
| η | 0.0002169 | Pa×s | 704.65 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Ketopimelic.
Sources
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