- InChI
- InChI=1S/C21H24O8/c1-21(2,19(22)28-17-13(24-3)9-7-10-14(17)25-4)20(23)29-18-15(26-5)11-8-12-16(18)27-6/h7-12H,1-6H3
- InChI Key
- YOWLGKYNJLXXEY-UHFFFAOYSA-N
- Formula
- C21H24O8
- SMILES
-
COc1cccc(OC)c1OC(=O)C(C)(C)C(=
O)Oc1c(OC)cccc1OC - Molecular Weight1
- 404.41
- 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° | -572.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1076.82 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 39.58 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 96.20 | kJ/mol | Joback Calculated Property |
| log10WS | -4.40 | Crippen Calculated Property | |
| logPoct/wat | 3.258 | Crippen Calculated Property | |
| McVol | 297.590 | ml/mol | McGowan Calculated Property |
| Pc | 1491.89 | kPa | Joback Calculated Property |
| Inp | [2776.00; 2776.00] |
|
|
| Inp | 2776.00 | NIST | |
| Inp | 2776.00 | NIST | |
| Tboil | 992.19 | K | Joback Calculated Property |
| Tc | 1224.17 | K | Joback Calculated Property |
| Tfus | 665.01 | K | Joback Calculated Property |
| Vc | 1.105 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [941.83; 973.12] | J/mol×K | [992.19; 1224.17] |
|
| Cp,gas | 941.83 | J/mol×K | 992.19 | Joback Calculated Property |
| Cp,gas | 951.96 | J/mol×K | 1030.85 | Joback Calculated Property |
| Cp,gas | 960.16 | J/mol×K | 1069.52 | Joback Calculated Property |
| Cp,gas | 966.40 | J/mol×K | 1108.18 | Joback Calculated Property |
| Cp,gas | 970.67 | J/mol×K | 1146.84 | Joback Calculated Property |
| Cp,gas | 972.92 | J/mol×K | 1185.50 | Joback Calculated Property |
| Cp,gas | 973.12 | J/mol×K | 1224.17 | Joback Calculated Property |
| η | [0.0000121; 0.0000729] | Pa×s | [665.01; 992.19] |
|
| η | 0.0000729 | Pa×s | 665.01 | Joback Calculated Property |
| η | 0.0000483 | Pa×s | 719.54 | Joback Calculated Property |
| η | 0.0000339 | Pa×s | 774.07 | Joback Calculated Property |
| η | 0.0000249 | Pa×s | 828.60 | Joback Calculated Property |
| η | 0.0000190 | Pa×s | 883.13 | Joback Calculated Property |
| η | 0.0000150 | Pa×s | 937.66 | Joback Calculated Property |
| η | 0.0000121 | Pa×s | 992.19 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, di(2,6-dimethoxyphenyl) ester.
Sources
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