- InChI
- InChI=1S/C24H46O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-18-28-23(25)20-27-21-24(26)29-19-16-17-22(2)3/h22H,4-21H2,1-3H3
- InChI Key
- HJVUPVGAQBIUSD-UHFFFAOYSA-N
- Formula
- C24H46O5
- SMILES
-
CCCCCCCCCCCCCCOC(=O)COCC(=O)OC
CCC(C)C - Molecular Weight1
- 414.62
- 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 | 1.1976 | Relay (1.0) Calculated Property | |
| ΔfG° | -576.98 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1286.22 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 64.32 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 114.27 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.52 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.19 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.227 | Crippen Calculated Property | |
| McVol | 369.770 | ml/mol | McGowan Calculated Property |
| Pc | 806.62 | kPa | Joback Calculated Property |
| Inp | [3544.00; 3544.00] |
|
|
| Inp | 3544.00 | NIST | |
| Inp | 3544.00 | NIST | |
| Tboil | 656.48 | K | Relay (1.0) Calculated Property |
| Tc | 826.84 | K | Relay (1.0) Calculated Property |
| Tfus | 293.63 | K | Relay (1.0) Calculated Property |
| Vc | 1.419 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1231.93; 1328.05] | J/mol×K | [887.14; 1087.26] |
|
| Cp,gas | 1231.93 | J/mol×K | 887.14 | Joback Calculated Property |
| Cp,gas | 1251.74 | J/mol×K | 920.49 | Joback Calculated Property |
| Cp,gas | 1270.00 | J/mol×K | 953.85 | Joback Calculated Property |
| Cp,gas | 1286.74 | J/mol×K | 987.20 | Joback Calculated Property |
| Cp,gas | 1301.98 | J/mol×K | 1020.55 | Joback Calculated Property |
| Cp,gas | 1315.74 | J/mol×K | 1053.91 | Joback Calculated Property |
| Cp,gas | 1328.05 | J/mol×K | 1087.26 | Joback Calculated Property |
| η | [0.0000153; 0.0006877] | Pa×s | [452.13; 887.14] |
|
| η | 0.0006877 | Pa×s | 452.13 | Joback Calculated Property |
| η | 0.0002352 | Pa×s | 524.63 | Joback Calculated Property |
| η | 0.0001044 | Pa×s | 597.13 | Joback Calculated Property |
| η | 0.0000553 | Pa×s | 669.63 | Joback Calculated Property |
| η | 0.0000331 | Pa×s | 742.14 | Joback Calculated Property |
| η | 0.0000217 | Pa×s | 814.64 | Joback Calculated Property |
| η | 0.0000153 | Pa×s | 887.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, isohexyl tetradecyl ester.
Sources
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