- InChI
- InChI=1S/C18H26O5/c1-4-5-6-7-10-22-17(19)12-21-13-18(20)23-16-11-14(2)8-9-15(16)3/h8-9,11H,4-7,10,12-13H2,1-3H3
- InChI Key
- HZTFCUMIWAZXOY-UHFFFAOYSA-N
- Formula
- C18H26O5
- SMILES
-
CCCCCCOC(=O)COCC(=O)Oc1cc(C)cc
c1C - Molecular Weight1
- 322.40
- 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° | -379.01 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -823.08 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.40 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.98 | kJ/mol | Joback Calculated Property |
| log10WS | -4.04 | Crippen Calculated Property | |
| logPoct/wat | 3.349 | Crippen Calculated Property | |
| McVol | 261.470 | ml/mol | McGowan Calculated Property |
| Pc | 1514.03 | kPa | Joback Calculated Property |
| Inp | [2828.00; 2828.00] |
|
|
| Inp | 2828.00 | NIST | |
| Inp | 2828.00 | NIST | |
| Tboil | 822.88 | K | Joback Calculated Property |
| Tc | 1023.72 | K | Joback Calculated Property |
| Tfus | 510.63 | K | Joback Calculated Property |
| Vc | 1.002 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [789.23; 863.61] | J/mol×K | [822.88; 1023.72] |
|
| Cp,gas | 789.23 | J/mol×K | 822.88 | Joback Calculated Property |
| Cp,gas | 804.38 | J/mol×K | 856.35 | Joback Calculated Property |
| Cp,gas | 818.44 | J/mol×K | 889.83 | Joback Calculated Property |
| Cp,gas | 831.39 | J/mol×K | 923.30 | Joback Calculated Property |
| Cp,gas | 843.23 | J/mol×K | 956.78 | Joback Calculated Property |
| Cp,gas | 853.98 | J/mol×K | 990.25 | Joback Calculated Property |
| Cp,gas | 863.61 | J/mol×K | 1023.72 | Joback Calculated Property |
| η | [0.0000550; 0.0004391] | Pa×s | [510.63; 822.88] |
|
| η | 0.0004391 | Pa×s | 510.63 | Joback Calculated Property |
| η | 0.0002647 | Pa×s | 562.67 | Joback Calculated Property |
| η | 0.0001738 | Pa×s | 614.71 | Joback Calculated Property |
| η | 0.0001219 | Pa×s | 666.75 | Joback Calculated Property |
| η | 0.0000900 | Pa×s | 718.80 | Joback Calculated Property |
| η | 0.0000692 | Pa×s | 770.84 | Joback Calculated Property |
| η | 0.0000550 | Pa×s | 822.88 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, 2,5-dimethylphenyl hexyl ester.
Sources
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