- InChI
- InChI=1S/C14H22O6/c1-9(15)11(3)19-13(17)7-5-6-8-14(18)20-12(4)10(2)16/h11-12H,5-8H2,1-4H3
- InChI Key
- DXBGSZKUGZQFII-UHFFFAOYSA-N
- Formula
- C14H22O6
- SMILES
-
CC(=O)C(C)OC(=O)CCCCC(=O)OC(C)
C(C)=O - Molecular Weight1
- 286.32
- 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° | -663.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1057.61 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.74 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.79 | kJ/mol | Joback Calculated Property |
| log10WS | -2.19 | Crippen Calculated Property | |
| logPoct/wat | 1.588 | Crippen Calculated Property | |
| McVol | 226.140 | ml/mol | McGowan Calculated Property |
| Pc | 1845.16 | kPa | Joback Calculated Property |
| Inp | [1949.00; 1949.00] |
|
|
| Inp | 1949.00 | NIST | |
| Inp | 1949.00 | NIST | |
| Tboil | 779.16 | K | Joback Calculated Property |
| Tc | 974.73 | K | Joback Calculated Property |
| Tfus | 461.72 | K | Joback Calculated Property |
| Vc | 0.868 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [662.46; 729.46] | J/mol×K | [779.16; 974.73] |
|
| Cp,gas | 662.46 | J/mol×K | 779.16 | Joback Calculated Property |
| Cp,gas | 675.88 | J/mol×K | 811.76 | Joback Calculated Property |
| Cp,gas | 688.40 | J/mol×K | 844.35 | Joback Calculated Property |
| Cp,gas | 700.02 | J/mol×K | 876.95 | Joback Calculated Property |
| Cp,gas | 710.73 | J/mol×K | 909.54 | Joback Calculated Property |
| Cp,gas | 720.55 | J/mol×K | 942.14 | Joback Calculated Property |
| Cp,gas | 729.46 | J/mol×K | 974.73 | Joback Calculated Property |
| η | [0.0000961; 0.0012786] | Pa×s | [461.72; 779.16] |
|
| η | 0.0012786 | Pa×s | 461.72 | Joback Calculated Property |
| η | 0.0006654 | Pa×s | 514.63 | Joback Calculated Property |
| η | 0.0003911 | Pa×s | 567.53 | Joback Calculated Property |
| η | 0.0002517 | Pa×s | 620.44 | Joback Calculated Property |
| η | 0.0001736 | Pa×s | 673.35 | Joback Calculated Property |
| η | 0.0001264 | Pa×s | 726.25 | Joback Calculated Property |
| η | 0.0000961 | Pa×s | 779.16 | Joback Calculated Property |
Similar Compounds
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Sources
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