- InChI
- InChI=1S/C17H30O4/c1-5-8-10-15(7-3)13-20-16(18)11-9-12-17(19)21-14(4)6-2/h6,14-15H,2,5,7-13H2,1,3-4H3
- InChI Key
- MGJJVUJFODGCPL-UHFFFAOYSA-N
- Formula
- C17H30O4
- SMILES
-
C=CC(C)OC(=O)CCCC(=O)OCC(CC)CC
CC - Molecular Weight1
- 298.42
- 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° | -292.62 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -768.94 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.03 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 70.30 | kJ/mol | Joback Calculated Property |
| log10WS | -4.39 | Crippen Calculated Property | |
| logPoct/wat | 4.034 | Crippen Calculated Property | |
| McVol | 260.970 | ml/mol | McGowan Calculated Property |
| Pc | 1371.74 | kPa | Joback Calculated Property |
| Inp | [1870.00; 1870.00] |
|
|
| Inp | 1870.00 | NIST | |
| Inp | 1870.00 | NIST | |
| Tboil | 736.74 | K | Joback Calculated Property |
| Tc | 918.83 | K | Joback Calculated Property |
| Tfus | 393.91 | K | Joback Calculated Property |
| Vc | 1.004 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [766.82; 854.64] | J/mol×K | [736.74; 918.83] |
|
| Cp,gas | 766.82 | J/mol×K | 736.74 | Joback Calculated Property |
| Cp,gas | 783.65 | J/mol×K | 767.09 | Joback Calculated Property |
| Cp,gas | 799.59 | J/mol×K | 797.44 | Joback Calculated Property |
| Cp,gas | 814.65 | J/mol×K | 827.78 | Joback Calculated Property |
| Cp,gas | 828.83 | J/mol×K | 858.13 | Joback Calculated Property |
| Cp,gas | 842.16 | J/mol×K | 888.48 | Joback Calculated Property |
| Cp,gas | 854.64 | J/mol×K | 918.83 | Joback Calculated Property |
| η | [0.0000731; 0.0016896] | Pa×s | [393.91; 736.74] |
|
| η | 0.0016896 | Pa×s | 393.91 | Joback Calculated Property |
| η | 0.0007187 | Pa×s | 451.05 | Joback Calculated Property |
| η | 0.0003705 | Pa×s | 508.19 | Joback Calculated Property |
| η | 0.0002183 | Pa×s | 565.33 | Joback Calculated Property |
| η | 0.0001418 | Pa×s | 622.46 | Joback Calculated Property |
| η | 0.0000990 | Pa×s | 679.60 | Joback Calculated Property |
| η | 0.0000731 | Pa×s | 736.74 | Joback Calculated Property |
Similar Compounds
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Sources
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