- InChI
- InChI=1S/C17H32O5/c1-3-5-6-7-8-9-10-11-12-13-22-17(19)15-20-14-16(18)21-4-2/h3-15H2,1-2H3
- InChI Key
- XPKKAFUVBMWOPQ-UHFFFAOYSA-N
- Formula
- C17H32O5
- SMILES
- CCCCCCCCCCCOC(=O)COCC(=O)OCC
- Molecular Weight1
- 316.44
- 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 | 0.9772 | Relay (1.0) Calculated Property | |
| ΔfG° | -633.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1135.78 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 49.71 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 95.08 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.31 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.24 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.640 | Crippen Calculated Property | |
| McVol | 271.140 | ml/mol | McGowan Calculated Property |
| Pc | 1225.12 | kPa | Joback Calculated Property |
| Inp | [2665.00; 2665.00] |
|
|
| Inp | 2665.00 | NIST | |
| Inp | 2665.00 | NIST | |
| Tboil | 607.29 | K | Relay (1.0) Calculated Property |
| Tc | 775.39 | K | Relay (1.0) Calculated Property |
| Tfus | 281.81 | K | Relay (1.0) Calculated Property |
| Vc | 1.052 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [806.23; 894.92] | J/mol×K | [727.42; 900.64] |
|
| Cp,gas | 806.23 | J/mol×K | 727.42 | Joback Calculated Property |
| Cp,gas | 823.30 | J/mol×K | 756.29 | Joback Calculated Property |
| Cp,gas | 839.44 | J/mol×K | 785.16 | Joback Calculated Property |
| Cp,gas | 854.68 | J/mol×K | 814.03 | Joback Calculated Property |
| Cp,gas | 869.00 | J/mol×K | 842.90 | Joback Calculated Property |
| Cp,gas | 882.41 | J/mol×K | 871.77 | Joback Calculated Property |
| Cp,gas | 894.92 | J/mol×K | 900.64 | Joback Calculated Property |
| η | [0.0000491; 0.0014399] | Pa×s | [388.24; 727.42] |
|
| η | 0.0014399 | Pa×s | 388.24 | Joback Calculated Property |
| η | 0.0005734 | Pa×s | 444.77 | Joback Calculated Property |
| η | 0.0002810 | Pa×s | 501.30 | Joback Calculated Property |
| η | 0.0001591 | Pa×s | 557.83 | Joback Calculated Property |
| η | 0.0001001 | Pa×s | 614.36 | Joback Calculated Property |
| η | 0.0000680 | Pa×s | 670.89 | Joback Calculated Property |
| η | 0.0000491 | Pa×s | 727.42 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, ethyl undecyl ester.
Sources
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