- InChI
- InChI=1S/C18H30O6/c1-11(2)13(19)17(5,6)15(21)23-9-10-24-16(22)18(7,8)14(20)12(3)4/h11-12H,9-10H2,1-8H3
- InChI Key
- BEGGHCFDNUXHDL-UHFFFAOYSA-N
- Formula
- C18H30O6
- SMILES
-
CC(C)C(=O)C(C)(C)C(=O)OCCOC(=O
)C(C)(C)C(=O)C(C)C - Molecular Weight1
- 342.43
- CAS
- 4447-67-0
- 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).
- 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° | -624.20 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1157.67 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.10 | kJ/mol | Joback Calculated Property |
| log10WS | -2.68 | Crippen Calculated Property | |
| logPoct/wat | 2.575 | Crippen Calculated Property | |
| McVol | 282.500 | ml/mol | McGowan Calculated Property |
| Pc | 1398.55 | kPa | Joback Calculated Property |
| Tboil | 864.22 | K | Joback Calculated Property |
| Tc | 1071.19 | K | Joback Calculated Property |
| Tfus | 511.64 | K | Joback Calculated Property |
| Vc | 1.069 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [893.32; 965.97] | J/mol×K | [864.22; 1071.19] | 
|
| Cp,gas | 893.32 | J/mol×K | 864.22 | Joback Calculated Property |
| Cp,gas | 908.05 | J/mol×K | 898.71 | Joback Calculated Property |
| Cp,gas | 921.67 | J/mol×K | 933.21 | Joback Calculated Property |
| Cp,gas | 934.22 | J/mol×K | 967.70 | Joback Calculated Property |
| Cp,gas | 945.76 | J/mol×K | 1002.20 | Joback Calculated Property |
| Cp,gas | 956.32 | J/mol×K | 1036.69 | Joback Calculated Property |
| Cp,gas | 965.97 | J/mol×K | 1071.19 | Joback Calculated Property |
| η | [0.0000332; 0.0006820] | Pa×s | [511.64; 864.22] |
|
| η | 0.0006820 | Pa×s | 511.64 | Joback Calculated Property |
| η | 0.0003179 | Pa×s | 570.40 | Joback Calculated Property |
| η | 0.0001709 | Pa×s | 629.17 | Joback Calculated Property |
| η | 0.0001021 | Pa×s | 687.93 | Joback Calculated Property |
| η | 0.0000662 | Pa×s | 746.69 | Joback Calculated Property |
| η | 0.0000457 | Pa×s | 805.46 | Joback Calculated Property |
| η | 0.0000332 | Pa×s | 864.22 | Joback Calculated Property |
Similar Compounds
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Sources
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