- InChI
- InChI=1S/C13H14O6/c1-2-18-12(15)8-17-9-13(16)19-11-6-4-3-5-10(11)7-14/h3-7H,2,8-9H2,1H3
- InChI Key
- GBOKTVHRCQQYET-UHFFFAOYSA-N
- Formula
- C13H14O6
- SMILES
- CCOC(=O)COCC(=O)Oc1ccccc1C=O
- Molecular Weight1
- 266.25
- 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).
- 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 |
|---|---|---|---|
| ω | 0.7935 | Relay (1.0) Calculated Property | |
| ΔfG° | -511.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -901.27 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 32.13 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 86.66 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.72 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.91 | Relay (1.0) Calculated Property | |
| logPoct/wat | 0.984 | Crippen Calculated Property | |
| McVol | 192.590 | ml/mol | McGowan Calculated Property |
| Pc | 2497.50 | kPa | Joback Calculated Property |
| Inp | [2460.00; 2460.00] |
|
|
| Inp | 2460.00 | NIST | |
| Inp | 2460.00 | NIST | |
| Tboil | 611.67 | K | Relay (1.0) Calculated Property |
| Tc | 830.56 | K | Relay (1.0) Calculated Property |
| Tfus | 301.52 | K | Relay (1.0) Calculated Property |
| Vc | 0.704 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [527.80; 585.75] | J/mol×K | [752.16; 961.58] |
|
| Cp,gas | 527.80 | J/mol×K | 752.16 | Joback Calculated Property |
| Cp,gas | 539.72 | J/mol×K | 787.06 | Joback Calculated Property |
| Cp,gas | 550.75 | J/mol×K | 821.97 | Joback Calculated Property |
| Cp,gas | 560.88 | J/mol×K | 856.87 | Joback Calculated Property |
| Cp,gas | 570.09 | J/mol×K | 891.78 | Joback Calculated Property |
| Cp,gas | 578.39 | J/mol×K | 926.68 | Joback Calculated Property |
| Cp,gas | 585.75 | J/mol×K | 961.58 | Joback Calculated Property |
| η | [0.0001146; 0.0007615] | Pa×s | [483.76; 752.16] |
|
| η | 0.0007615 | Pa×s | 483.76 | Joback Calculated Property |
| η | 0.0004859 | Pa×s | 528.49 | Joback Calculated Property |
| η | 0.0003325 | Pa×s | 573.23 | Joback Calculated Property |
| η | 0.0002404 | Pa×s | 617.96 | Joback Calculated Property |
| η | 0.0001816 | Pa×s | 662.69 | Joback Calculated Property |
| η | 0.0001422 | Pa×s | 707.43 | Joback Calculated Property |
| η | 0.0001146 | Pa×s | 752.16 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, ethyl 2-formylphenyl ester.
Sources
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