- InChI
- InChI=1S/C16H28O8/c1-6-19-9-12-13(22-10(4)17)14(20-7-2)15(21-8-3)16(24-12)23-11(5)18/h12-16H,6-9H2,1-5H3/t12-,13-,14+,15-,16-/m0/s1
- InChI Key
- RKQQDKAUQIJGQH-QMHWVQJVSA-N
- Formula
- C16H28O8
- SMILES
-
CCOCC1OC(OC(C)=O)C(OCC)C(OCC)C
1OC(C)=O - Molecular Weight1
- 348.39
- 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° | -791.51 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1418.87 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 50.43 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.45 | kJ/mol | Joback Calculated Property |
| log10WS | -1.54 | Crippen Calculated Property | |
| logPoct/wat | 1.053 | Crippen Calculated Property | |
| McVol | 263.800 | ml/mol | McGowan Calculated Property |
| Pc | 1425.07 | kPa | Joback Calculated Property |
| Inp | [2064.00; 2064.00] |
|
|
| Inp | 2064.00 | NIST | |
| Inp | 2064.00 | NIST | |
| Tboil | 813.14 | K | Joback Calculated Property |
| Tc | 1009.29 | K | Joback Calculated Property |
| Tfus | 498.08 | K | Joback Calculated Property |
| Vc | 0.984 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [866.57; 949.19] | J/mol×K | [813.14; 1009.29] |
|
| Cp,gas | 866.57 | J/mol×K | 813.14 | Joback Calculated Property |
| Cp,gas | 884.08 | J/mol×K | 845.83 | Joback Calculated Property |
| Cp,gas | 900.15 | J/mol×K | 878.52 | Joback Calculated Property |
| Cp,gas | 914.75 | J/mol×K | 911.22 | Joback Calculated Property |
| Cp,gas | 927.82 | J/mol×K | 943.91 | Joback Calculated Property |
| Cp,gas | 939.32 | J/mol×K | 976.60 | Joback Calculated Property |
| Cp,gas | 949.19 | J/mol×K | 1009.29 | Joback Calculated Property |
| η | [0.0000948; 0.0005588] | Pa×s | [498.08; 813.14] |
|
| η | 0.0005588 | Pa×s | 498.08 | Joback Calculated Property |
| η | 0.0003611 | Pa×s | 550.59 | Joback Calculated Property |
| η | 0.0002518 | Pa×s | 603.10 | Joback Calculated Property |
| η | 0.0001860 | Pa×s | 655.61 | Joback Calculated Property |
| η | 0.0001437 | Pa×s | 708.12 | Joback Calculated Property |
| η | 0.0001151 | Pa×s | 760.63 | Joback Calculated Property |
| η | 0.0000948 | Pa×s | 813.14 | Joback Calculated Property |
Similar Compounds
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Sources
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