- InChI
- InChI=1S/C23H44O5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-27-21(24)18-26-19-22(25)28-20-23(2,3)4/h5-20H2,1-4H3
- InChI Key
- YUUVGIZDJOTVTR-UHFFFAOYSA-N
- Formula
- C23H44O5
- SMILES
-
CCCCCCCCCCCCCCOC(=O)COCC(=O)OC
C(C)(C)C - Molecular Weight1
- 400.59
- 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° | -427.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1148.62 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 54.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 86.22 | kJ/mol | Joback Calculated Property |
| log10WS | -6.02 | Crippen Calculated Property | |
| logPoct/wat | 5.837 | Crippen Calculated Property | |
| McVol | 355.680 | ml/mol | McGowan Calculated Property |
| Pc | 900.72 | kPa | Joback Calculated Property |
| Inp | [3246.00; 3246.00] |
|
|
| Inp | 3246.00 | NIST | |
| Inp | 3246.00 | NIST | |
| Tboil | 897.41 | K | Joback Calculated Property |
| Tc | 1098.80 | K | Joback Calculated Property |
| Tfus | 517.94 | K | Joback Calculated Property |
| Vc | 1.379 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1186.80; 1281.64] | J/mol×K | [897.41; 1098.80] |
|
| Cp,gas | 1186.80 | J/mol×K | 897.41 | Joback Calculated Property |
| Cp,gas | 1205.89 | J/mol×K | 930.98 | Joback Calculated Property |
| Cp,gas | 1223.63 | J/mol×K | 964.54 | Joback Calculated Property |
| Cp,gas | 1240.04 | J/mol×K | 998.11 | Joback Calculated Property |
| Cp,gas | 1255.15 | J/mol×K | 1031.67 | Joback Calculated Property |
| Cp,gas | 1269.01 | J/mol×K | 1065.24 | Joback Calculated Property |
| Cp,gas | 1281.64 | J/mol×K | 1098.80 | Joback Calculated Property |
| η | [0.0000197; 0.0003645] | Pa×s | [517.94; 897.41] |
|
| η | 0.0003645 | Pa×s | 517.94 | Joback Calculated Property |
| η | 0.0001720 | Pa×s | 581.19 | Joback Calculated Property |
| η | 0.0000940 | Pa×s | 644.43 | Joback Calculated Property |
| η | 0.0000573 | Pa×s | 707.67 | Joback Calculated Property |
| η | 0.0000378 | Pa×s | 770.92 | Joback Calculated Property |
| η | 0.0000266 | Pa×s | 834.16 | Joback Calculated Property |
| η | 0.0000197 | Pa×s | 897.41 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, neopentyl tetradecyl ester.
Sources
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