- InChI
- InChI=1S/C14H26O5/c1-5-6-7-8-18-12(15)9-17-10-13(16)19-11-14(2,3)4/h5-11H2,1-4H3
- InChI Key
- IMKYHWXLGSKCRH-UHFFFAOYSA-N
- Formula
- C14H26O5
- SMILES
- CCCCCOC(=O)COCC(=O)OCC(C)(C)C
- Molecular Weight1
- 274.35
- 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° | -503.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -962.86 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 31.36 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.18 | kJ/mol | Joback Calculated Property |
| log10WS | -2.25 | Crippen Calculated Property | |
| logPoct/wat | 2.326 | Crippen Calculated Property | |
| McVol | 228.870 | ml/mol | McGowan Calculated Property |
| Pc | 1641.76 | kPa | Joback Calculated Property |
| Inp | [2133.00; 2133.00] |
|
|
| Inp | 2133.00 | NIST | |
| Inp | 2133.00 | NIST | |
| Tboil | 691.49 | K | Joback Calculated Property |
| Tc | 874.22 | K | Joback Calculated Property |
| Tfus | 416.51 | K | Joback Calculated Property |
| Vc | 0.875 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [653.43; 736.14] | J/mol×K | [691.49; 874.22] |
|
| Cp,gas | 653.43 | J/mol×K | 691.49 | Joback Calculated Property |
| Cp,gas | 669.24 | J/mol×K | 721.94 | Joback Calculated Property |
| Cp,gas | 684.23 | J/mol×K | 752.40 | Joback Calculated Property |
| Cp,gas | 698.40 | J/mol×K | 782.85 | Joback Calculated Property |
| Cp,gas | 711.78 | J/mol×K | 813.31 | Joback Calculated Property |
| Cp,gas | 724.35 | J/mol×K | 843.76 | Joback Calculated Property |
| Cp,gas | 736.14 | J/mol×K | 874.22 | Joback Calculated Property |
| η | [0.0000777; 0.0010508] | Pa×s | [416.51; 691.49] |
|
| η | 0.0010508 | Pa×s | 416.51 | Joback Calculated Property |
| η | 0.0005490 | Pa×s | 462.34 | Joback Calculated Property |
| η | 0.0003225 | Pa×s | 508.17 | Joback Calculated Property |
| η | 0.0002068 | Pa×s | 554.00 | Joback Calculated Property |
| η | 0.0001420 | Pa×s | 599.83 | Joback Calculated Property |
| η | 0.0001028 | Pa×s | 645.66 | Joback Calculated Property |
| η | 0.0000777 | Pa×s | 691.49 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, neopentyl pentyl ester.
Sources
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