- InChI
- InChI=1S/C25H48O5/c1-6-7-8-9-10-11-12-13-14-15-16-17-29-23(26)20-28-21-24(27)30-19-22(2)18-25(3,4)5/h22H,6-21H2,1-5H3
- InChI Key
- WRTNHRNXYIIDRS-UHFFFAOYSA-N
- Formula
- C25H48O5
- SMILES
-
CCCCCCCCCCCCCOC(=O)COCC(=O)OCC
(C)CC(C)(C)C - Molecular Weight1
- 428.65
- 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° | -412.82 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1195.18 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 56.33 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 90.28 | kJ/mol | Joback Calculated Property |
| log10WS | -6.62 | Crippen Calculated Property | |
| logPoct/wat | 6.473 | Crippen Calculated Property | |
| McVol | 383.860 | ml/mol | McGowan Calculated Property |
| Pc | 808.91 | kPa | Joback Calculated Property |
| Inp | [3411.00; 3411.00] |
|
|
| Inp | 3411.00 | NIST | |
| Inp | 3411.00 | NIST | |
| Tboil | 942.73 | K | Joback Calculated Property |
| Tc | 1156.42 | K | Joback Calculated Property |
| Tfus | 525.48 | K | Joback Calculated Property |
| Vc | 1.484 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1313.44; 1409.89] | J/mol×K | [942.73; 1156.42] |
|
| Cp,gas | 1313.44 | J/mol×K | 942.73 | Joback Calculated Property |
| Cp,gas | 1333.33 | J/mol×K | 978.34 | Joback Calculated Property |
| Cp,gas | 1351.63 | J/mol×K | 1013.96 | Joback Calculated Property |
| Cp,gas | 1368.39 | J/mol×K | 1049.57 | Joback Calculated Property |
| Cp,gas | 1383.66 | J/mol×K | 1085.19 | Joback Calculated Property |
| Cp,gas | 1397.47 | J/mol×K | 1120.80 | Joback Calculated Property |
| Cp,gas | 1409.89 | J/mol×K | 1156.42 | Joback Calculated Property |
| η | [0.0000130; 0.0003191] | Pa×s | [525.48; 942.73] |
|
| η | 0.0003191 | Pa×s | 525.48 | Joback Calculated Property |
| η | 0.0001370 | Pa×s | 595.02 | Joback Calculated Property |
| η | 0.0000702 | Pa×s | 664.56 | Joback Calculated Property |
| η | 0.0000408 | Pa×s | 734.11 | Joback Calculated Property |
| η | 0.0000261 | Pa×s | 803.65 | Joback Calculated Property |
| η | 0.0000179 | Pa×s | 873.19 | Joback Calculated Property |
| η | 0.0000130 | Pa×s | 942.73 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, tridecyl 2,4,4-trimethylpentyl ester.
Sources
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