- InChI
- InChI=1S/C17H32O5/c1-3-5-7-9-11-13-22-17(19)15-20-14-16(18)21-12-10-8-6-4-2/h3-15H2,1-2H3
- InChI Key
- PEJPWXNGSKPPGE-UHFFFAOYSA-N
- Formula
- C17H32O5
- SMILES
- CCCCCCCOC(=O)COCC(=O)OCCCCCC
- Molecular Weight1
- 316.43
- 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 | 0.9887 | Relay (... Calculated Property | |
| ΔfG° | -480.58 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1134.49 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 46.55 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 90.32 | kJ/mol | Relay (... Calculated Property |
| IE | 9.32 | eV | Relay (... Calculated Property |
| log10WS | -4.06 | Relay (... Calculated Property | |
| logPoct/wat | 3.640 | Crippen Calculated Property | |
| McVol | 271.140 | ml/mol | McGowan Calculated Property |
| Pc | 1298.60 | kPa | Joback Calculated Property |
| Inp | [2633.00; 2633.00] |
|
|
| Inp | 2633.00 | NIST | |
| Inp | 2633.00 | NIST | |
| Tboil | 607.86 | K | Relay (... Calculated Property |
| Tc | 774.23 | K | Relay (... Calculated Property |
| Tfus | 275.40 | K | Relay (... Calculated Property |
| Vc | 1.048 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [821.57; 908.76] | J/mol×K | [763.36; 942.36] |
|
| Cp,gas | 821.57 | J/mol×K | 763.36 | Joback Calculated Property |
| Cp,gas | 838.37 | J/mol×K | 793.19 | Joback Calculated Property |
| Cp,gas | 854.26 | J/mol×K | 823.03 | Joback Calculated Property |
| Cp,gas | 869.24 | J/mol×K | 852.86 | Joback Calculated Property |
| Cp,gas | 883.32 | J/mol×K | 882.69 | Joback Calculated Property |
| Cp,gas | 896.49 | J/mol×K | 912.53 | Joback Calculated Property |
| Cp,gas | 908.76 | J/mol×K | 942.36 | Joback Calculated Property |
| η | [0.0000613; 0.0007897] | Pa×s | [447.90; 763.36] |
|
| η | 0.0007897 | Pa×s | 447.90 | Joback Calculated Property |
| η | 0.0004124 | Pa×s | 500.48 | Joback Calculated Property |
| η | 0.0002437 | Pa×s | 553.05 | Joback Calculated Property |
| η | 0.0001578 | Pa×s | 605.63 | Joback Calculated Property |
| η | 0.0001095 | Pa×s | 658.21 | Joback Calculated Property |
| η | 0.0000802 | Pa×s | 710.78 | Joback Calculated Property |
| η | 0.0000613 | Pa×s | 763.36 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, heptyl hexyl ester.
Sources
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