- InChI
- InChI=1S/C23H36O5/c1-2-3-4-5-6-7-8-9-13-17-27-22(24)19-26-20-23(25)28-18-16-21-14-11-10-12-15-21/h10-12,14-15H,2-9,13,16-20H2,1H3
- InChI Key
- RTDVZTDLJWVXHU-UHFFFAOYSA-N
- Formula
- C23H36O5
- SMILES
-
CCCCCCCCCCCOC(=O)COCC(=O)OCCc1
ccccc1 - Molecular Weight1
- 392.53
- 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 | 1.1166 | Relay (1.0) Calculated Property | |
| ΔfG° | -470.55 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -998.47 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 59.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 118.27 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.65 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.40 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.863 | Crippen Calculated Property | |
| McVol | 331.920 | ml/mol | McGowan Calculated Property |
| Pc | 1039.24 | kPa | Joback Calculated Property |
| Inp | [3641.00; 3641.00] |
|
|
| Inp | 3641.00 | NIST | |
| Inp | 3641.00 | NIST | |
| Tboil | 680.30 | K | Relay (1.0) Calculated Property |
| Tc | 867.40 | K | Relay (1.0) Calculated Property |
| Tfus | 296.01 | K | Relay (1.0) Calculated Property |
| Vc | 1.250 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1073.88; 1152.10] | J/mol×K | [891.38; 1092.99] |
|
| Cp,gas | 1073.88 | J/mol×K | 891.38 | Joback Calculated Property |
| Cp,gas | 1090.37 | J/mol×K | 924.98 | Joback Calculated Property |
| Cp,gas | 1105.45 | J/mol×K | 958.58 | Joback Calculated Property |
| Cp,gas | 1119.13 | J/mol×K | 992.18 | Joback Calculated Property |
| Cp,gas | 1131.44 | J/mol×K | 1025.78 | Joback Calculated Property |
| Cp,gas | 1142.43 | J/mol×K | 1059.38 | Joback Calculated Property |
| Cp,gas | 1152.10 | J/mol×K | 1092.99 | Joback Calculated Property |
| η | [0.0000199; 0.0005118] | Pa×s | [482.28; 891.38] |
|
| η | 0.0005118 | Pa×s | 482.28 | Joback Calculated Property |
| η | 0.0002131 | Pa×s | 550.46 | Joback Calculated Property |
| η | 0.0001077 | Pa×s | 618.65 | Joback Calculated Property |
| η | 0.0000623 | Pa×s | 686.83 | Joback Calculated Property |
| η | 0.0000398 | Pa×s | 755.01 | Joback Calculated Property |
| η | 0.0000274 | Pa×s | 823.20 | Joback Calculated Property |
| η | 0.0000199 | Pa×s | 891.38 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, phenethyl undecyl ester.
Sources
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