- InChI
- InChI=1S/C18H26O7/c1-13(2)7-6-10-24-16(19)11-23-12-17(20)25-18-14(21-3)8-5-9-15(18)22-4/h5,8-9,13H,6-7,10-12H2,1-4H3
- InChI Key
- AKMIURKZNIMYIK-UHFFFAOYSA-N
- Formula
- C18H26O7
- SMILES
-
COc1cccc(OC)c1OC(=O)COCC(=O)OC
CCC(C)C - Molecular Weight1
- 354.39
- 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° | -591.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1092.80 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 41.25 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.42 | kJ/mol | Joback Calculated Property |
| log10WS | -3.08 | Crippen Calculated Property | |
| logPoct/wat | 2.605 | Crippen Calculated Property | |
| McVol | 273.210 | ml/mol | McGowan Calculated Property |
| Pc | 1483.85 | kPa | Joback Calculated Property |
| Inp | [3062.00; 3062.00] |
|
|
| Inp | 3062.00 | NIST | |
| Inp | 3062.00 | NIST | |
| Tboil | 867.28 | K | Joback Calculated Property |
| Tc | 1071.89 | K | Joback Calculated Property |
| Tfus | 540.09 | K | Joback Calculated Property |
| Vc | 1.032 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [846.67; 911.51] | J/mol×K | [867.28; 1071.89] |
|
| Cp,gas | 846.67 | J/mol×K | 867.28 | Joback Calculated Property |
| Cp,gas | 860.89 | J/mol×K | 901.38 | Joback Calculated Property |
| Cp,gas | 873.78 | J/mol×K | 935.48 | Joback Calculated Property |
| Cp,gas | 885.31 | J/mol×K | 969.58 | Joback Calculated Property |
| Cp,gas | 895.46 | J/mol×K | 1003.68 | Joback Calculated Property |
| Cp,gas | 904.21 | J/mol×K | 1037.79 | Joback Calculated Property |
| Cp,gas | 911.51 | J/mol×K | 1071.89 | Joback Calculated Property |
| η | [0.0000284; 0.0002439] | Pa×s | [540.09; 867.28] |
|
| η | 0.0002439 | Pa×s | 540.09 | Joback Calculated Property |
| η | 0.0001447 | Pa×s | 594.62 | Joback Calculated Property |
| η | 0.0000937 | Pa×s | 649.15 | Joback Calculated Property |
| η | 0.0000649 | Pa×s | 703.68 | Joback Calculated Property |
| η | 0.0000474 | Pa×s | 758.22 | Joback Calculated Property |
| η | 0.0000361 | Pa×s | 812.75 | Joback Calculated Property |
| η | 0.0000284 | Pa×s | 867.28 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, 2,6-dimethoxyphenyl isohexyl ester.
Sources
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