- InChI
- InChI=1S/C7H10O5/c1-12-7(11)5(8)3-2-4-6(9)10/h2-4H2,1H3,(H,9,10)
- InChI Key
- YPGQZHZBRFDCNW-UHFFFAOYSA-N
- Formula
- C7H10O5
- SMILES
- COC(=O)C(=O)CCCC(=O)O
- Molecular Weight1
- 174.15
- 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° | -620.52 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -810.00 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 70.50 | kJ/mol | Joback Calculated Property |
| log10WS | 5.56e-03 | Crippen Calculated Property | |
| logPoct/wat | -0.017 | Crippen Calculated Property | |
| McVol | 125.940 | ml/mol | McGowan Calculated Property |
| Pc | 3782.33 | kPa | Joback Calculated Property |
| Inp | 1281.00 | NIST | |
| Tboil | 635.77 | K | Joback Calculated Property |
| Tc | 821.37 | K | Joback Calculated Property |
| Tfus | 401.49 | K | Joback Calculated Property |
| Vc | 0.482 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [313.59; 357.13] | J/mol×K | [635.77; 821.37] | 
|
| Cp,gas | 313.59 | J/mol×K | 635.77 | Joback Calculated Property |
| Cp,gas | 321.90 | J/mol×K | 666.70 | Joback Calculated Property |
| Cp,gas | 329.79 | J/mol×K | 697.64 | Joback Calculated Property |
| Cp,gas | 337.25 | J/mol×K | 728.57 | Joback Calculated Property |
| Cp,gas | 344.30 | J/mol×K | 759.50 | Joback Calculated Property |
| Cp,gas | 350.92 | J/mol×K | 790.43 | Joback Calculated Property |
| Cp,gas | 357.13 | J/mol×K | 821.37 | Joback Calculated Property |
| η | [0.0000944; 0.0024554] | Pa×s | [401.49; 635.77] |
|
| η | 0.0024554 | Pa×s | 401.49 | Joback Calculated Property |
| η | 0.0011214 | Pa×s | 440.54 | Joback Calculated Property |
| η | 0.0005819 | Pa×s | 479.58 | Joback Calculated Property |
| η | 0.0003333 | Pa×s | 518.63 | Joback Calculated Property |
| η | 0.0002064 | Pa×s | 557.68 | Joback Calculated Property |
| η | 0.0001361 | Pa×s | 596.72 | Joback Calculated Property |
| η | 0.0000944 | Pa×s | 635.77 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Oxo-hexanedioic acid 1-methyl ester.
Sources
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