- InChI
- InChI=1S/C11H14O4/c1-13-9-4-5-10(14-2)8(6-9)7-11(12)15-3/h4-6H,7H2,1-3H3
- InChI Key
- NGFZJWMCFOTWNI-UHFFFAOYSA-N
- Formula
- C11H14O4
- SMILES
- COC(=O)Cc1cc(OC)ccc1OC
- Molecular Weight1
- 210.23
- 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° | -309.03 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -566.02 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 57.66 | kJ/mol | Joback Calculated Property |
| log10WS | -1.80 | Crippen Calculated Property | |
| logPoct/wat | 1.419 | Crippen Calculated Property | |
| McVol | 161.270 | ml/mol | McGowan Calculated Property |
| Pc | 2600.43 | kPa | Joback Calculated Property |
| Inp | [1616.50; 1616.50] |
|
|
| Inp | 1616.50 | NIST | |
| Inp | 1616.50 | NIST | |
| Tboil | 608.85 | K | Joback Calculated Property |
| Tc | 815.75 | K | Joback Calculated Property |
| Tfus | 381.81 | K | Joback Calculated Property |
| Vc | 0.604 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [394.96; 465.87] | J/mol×K | [608.85; 815.75] |
|
| Cp,gas | 394.96 | J/mol×K | 608.85 | Joback Calculated Property |
| Cp,gas | 408.45 | J/mol×K | 643.33 | Joback Calculated Property |
| Cp,gas | 421.30 | J/mol×K | 677.82 | Joback Calculated Property |
| Cp,gas | 433.48 | J/mol×K | 712.30 | Joback Calculated Property |
| Cp,gas | 444.99 | J/mol×K | 746.78 | Joback Calculated Property |
| Cp,gas | 455.79 | J/mol×K | 781.27 | Joback Calculated Property |
| Cp,gas | 465.87 | J/mol×K | 815.75 | Joback Calculated Property |
| η | [0.0001254; 0.0007937] | Pa×s | [381.81; 608.85] |
|
| η | 0.0007937 | Pa×s | 381.81 | Joback Calculated Property |
| η | 0.0005080 | Pa×s | 419.65 | Joback Calculated Property |
| η | 0.0003500 | Pa×s | 457.49 | Joback Calculated Property |
| η | 0.0002553 | Pa×s | 495.33 | Joback Calculated Property |
| η | 0.0001948 | Pa×s | 533.17 | Joback Calculated Property |
| η | 0.0001540 | Pa×s | 571.01 | Joback Calculated Property |
| η | 0.0001254 | Pa×s | 608.85 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Homogentisic acid, dimethyl ether, methyl ester.
Sources
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