- InChI
- InChI=1S/C24H46O5/c1-6-7-8-9-10-11-12-13-14-15-16-28-22(25)19-27-20-23(26)29-18-21(2)17-24(3,4)5/h21H,6-20H2,1-5H3
- InChI Key
- CLPQMVLJUCHCMN-UHFFFAOYSA-N
- Formula
- C24H46O5
- SMILES
-
CCCCCCCCCCCCOC(=O)COCC(=O)OCC(
C)CC(C)(C)C - Molecular Weight1
- 414.62
- 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° | -421.24 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1174.54 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 53.74 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 88.06 | kJ/mol | Joback Calculated Property |
| log10WS | -6.20 | Crippen Calculated Property | |
| logPoct/wat | 6.083 | Crippen Calculated Property | |
| McVol | 369.770 | ml/mol | McGowan Calculated Property |
| Pc | 854.96 | kPa | Joback Calculated Property |
| Inp | [3297.00; 3297.00] |
|
|
| Inp | 3297.00 | NIST | |
| Inp | 3297.00 | NIST | |
| Tboil | 919.85 | K | Joback Calculated Property |
| Tc | 1126.76 | K | Joback Calculated Property |
| Tfus | 514.21 | K | Joback Calculated Property |
| Vc | 1.429 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1250.09; 1345.56] | J/mol×K | [919.85; 1126.76] |
|
| Cp,gas | 1250.09 | J/mol×K | 919.85 | Joback Calculated Property |
| Cp,gas | 1269.55 | J/mol×K | 954.34 | Joback Calculated Property |
| Cp,gas | 1287.53 | J/mol×K | 988.82 | Joback Calculated Property |
| Cp,gas | 1304.09 | J/mol×K | 1023.31 | Joback Calculated Property |
| Cp,gas | 1319.25 | J/mol×K | 1057.79 | Joback Calculated Property |
| Cp,gas | 1333.06 | J/mol×K | 1092.28 | Joback Calculated Property |
| Cp,gas | 1345.56 | J/mol×K | 1126.76 | Joback Calculated Property |
| η | [0.0000153; 0.0003674] | Pa×s | [514.21; 919.85] |
|
| η | 0.0003674 | Pa×s | 514.21 | Joback Calculated Property |
| η | 0.0001590 | Pa×s | 581.82 | Joback Calculated Property |
| η | 0.0000819 | Pa×s | 649.42 | Joback Calculated Property |
| η | 0.0000478 | Pa×s | 717.03 | Joback Calculated Property |
| η | 0.0000306 | Pa×s | 784.64 | Joback Calculated Property |
| η | 0.0000211 | Pa×s | 852.24 | Joback Calculated Property |
| η | 0.0000153 | Pa×s | 919.85 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, dodecyl 2,4,4-trimethylpentyl ester.
Sources
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