- InChI
- InChI=1S/C20H38O5/c1-6-9-10-11-14-24-18(21)20(7-2,8-3)19(22)25-16-13-17(4)12-15-23-5/h17H,6-16H2,1-5H3
- InChI Key
- XPXNKBZXKDGXKC-UHFFFAOYSA-N
- Formula
- C20H38O5
- SMILES
-
CCCCCCOC(=O)C(CC)(CC)C(=O)OCCC
(C)CCOC - Molecular Weight1
- 358.51
- 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° | -454.92 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1091.98 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 43.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.15 | kJ/mol | Joback Calculated Property |
| log10WS | -4.52 | Crippen Calculated Property | |
| logPoct/wat | 4.522 | Crippen Calculated Property | |
| McVol | 313.410 | ml/mol | McGowan Calculated Property |
| Pc | 1084.92 | kPa | Joback Calculated Property |
| Inp | 2117.00 | NIST | |
| Tboil | 828.33 | K | Joback Calculated Property |
| Tc | 1017.82 | K | Joback Calculated Property |
| Tfus | 469.13 | K | Joback Calculated Property |
| Vc | 1.204 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1002.14; 1093.65] | J/mol×K | [828.33; 1017.82] | 
|
| Cp,gas | 1002.14 | J/mol×K | 828.33 | Joback Calculated Property |
| Cp,gas | 1020.16 | J/mol×K | 859.91 | Joback Calculated Property |
| Cp,gas | 1037.05 | J/mol×K | 891.49 | Joback Calculated Property |
| Cp,gas | 1052.82 | J/mol×K | 923.08 | Joback Calculated Property |
| Cp,gas | 1067.49 | J/mol×K | 954.66 | Joback Calculated Property |
| Cp,gas | 1081.09 | J/mol×K | 986.24 | Joback Calculated Property |
| Cp,gas | 1093.65 | J/mol×K | 1017.82 | Joback Calculated Property |
| η | [0.0000290; 0.0006309] | Pa×s | [469.13; 828.33] |
|
| η | 0.0006309 | Pa×s | 469.13 | Joback Calculated Property |
| η | 0.0002825 | Pa×s | 529.00 | Joback Calculated Property |
| η | 0.0001489 | Pa×s | 588.86 | Joback Calculated Property |
| η | 0.0000884 | Pa×s | 648.73 | Joback Calculated Property |
| η | 0.0000573 | Pa×s | 708.60 | Joback Calculated Property |
| η | 0.0000397 | Pa×s | 768.46 | Joback Calculated Property |
| η | 0.0000290 | Pa×s | 828.33 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, hexyl 5-methoxy-3-methylpentyl ester.
Sources
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