- InChI
- InChI=1S/C14H24O4/c1-6-7-10-17-12(15)8-9-13(16)18-11(2)14(3,4)5/h8-9,11H,6-7,10H2,1-5H3/b9-8+
- InChI Key
- CQZZIOVGONTWTC-CMDGGOBGSA-N
- Formula
- C14H24O4
- SMILES
-
CCCCOC(=O)C=CC(=O)OC(C)C(C)(C)
C - Molecular Weight1
- 256.34
- 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° | -320.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -718.70 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 26.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.34 | kJ/mol | Joback Calculated Property |
| log10WS | -3.13 | Crippen Calculated Property | |
| logPoct/wat | 2.864 | Crippen Calculated Property | |
| McVol | 218.700 | ml/mol | McGowan Calculated Property |
| Pc | 1749.21 | kPa | Joback Calculated Property |
| Inp | [1634.00; 1634.00] |
|
|
| Inp | 1634.00 | NIST | |
| Inp | 1634.00 | NIST | |
| Tboil | 672.79 | K | Joback Calculated Property |
| Tc | 864.68 | K | Joback Calculated Property |
| Tfus | 374.20 | K | Joback Calculated Property |
| Vc | 0.831 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [603.25; 685.94] | J/mol×K | [672.79; 864.68] |
|
| Cp,gas | 603.25 | J/mol×K | 672.79 | Joback Calculated Property |
| Cp,gas | 619.12 | J/mol×K | 704.77 | Joback Calculated Property |
| Cp,gas | 634.12 | J/mol×K | 736.75 | Joback Calculated Property |
| Cp,gas | 648.27 | J/mol×K | 768.74 | Joback Calculated Property |
| Cp,gas | 661.60 | J/mol×K | 800.72 | Joback Calculated Property |
| Cp,gas | 674.15 | J/mol×K | 832.70 | Joback Calculated Property |
| Cp,gas | 685.94 | J/mol×K | 864.68 | Joback Calculated Property |
| η | [0.0000815; 0.0018211] | Pa×s | [374.20; 672.79] |
|
| η | 0.0018211 | Pa×s | 374.20 | Joback Calculated Property |
| η | 0.0008006 | Pa×s | 423.97 | Joback Calculated Property |
| η | 0.0004183 | Pa×s | 473.73 | Joback Calculated Property |
| η | 0.0002473 | Pa×s | 523.50 | Joback Calculated Property |
| η | 0.0001601 | Pa×s | 573.26 | Joback Calculated Property |
| η | 0.0001112 | Pa×s | 623.02 | Joback Calculated Property |
| η | 0.0000815 | Pa×s | 672.79 | Joback Calculated Property |
Similar Compounds
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Sources
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