- InChI
- InChI=1S/C19H28O4/c20-18(22-16-10-12-4-6-14(16)8-12)2-1-3-19(21)23-17-11-13-5-7-15(17)9-13/h12-17H,1-11H2
- InChI Key
- QTDRNQDUODEKEV-UHFFFAOYSA-N
- Formula
- C19H28O4
- SMILES
-
O=C(CCCC(=O)OC1CC2CCC1C2)OC1CC
2CCC1C2 - Molecular Weight1
- 320.42
- 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° | -155.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -686.89 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 41.02 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.58 | kJ/mol | Joback Calculated Property |
| log10WS | -4.34 | Crippen Calculated Property | |
| logPoct/wat | 3.620 | Crippen Calculated Property | |
| McVol | 250.010 | ml/mol | McGowan Calculated Property |
| Pc | 1671.43 | kPa | Joback Calculated Property |
| Inp | 2417.00 | NIST | |
| Tboil | 812.86 | K | Joback Calculated Property |
| Tc | 1028.63 | K | Joback Calculated Property |
| Tfus | 504.45 | K | Joback Calculated Property |
| Vc | 0.958 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [860.49; 961.83] | J/mol×K | [812.86; 1028.63] | 
|
| Cp,gas | 860.49 | J/mol×K | 812.86 | Joback Calculated Property |
| Cp,gas | 880.20 | J/mol×K | 848.82 | Joback Calculated Property |
| Cp,gas | 898.65 | J/mol×K | 884.78 | Joback Calculated Property |
| Cp,gas | 915.93 | J/mol×K | 920.74 | Joback Calculated Property |
| Cp,gas | 932.16 | J/mol×K | 956.71 | Joback Calculated Property |
| Cp,gas | 947.42 | J/mol×K | 992.67 | Joback Calculated Property |
| Cp,gas | 961.83 | J/mol×K | 1028.63 | Joback Calculated Property |
| η | [0.0040331; 0.0068488] | Pa×s | [504.45; 812.86] |
|
| η | 0.0068488 | Pa×s | 504.45 | Joback Calculated Property |
| η | 0.0060196 | Pa×s | 555.85 | Joback Calculated Property |
| η | 0.0054076 | Pa×s | 607.25 | Joback Calculated Property |
| η | 0.0049398 | Pa×s | 658.65 | Joback Calculated Property |
| η | 0.0045720 | Pa×s | 710.06 | Joback Calculated Property |
| η | 0.0042760 | Pa×s | 761.46 | Joback Calculated Property |
| η | 0.0040331 | Pa×s | 812.86 | Joback Calculated Property |
Similar Compounds
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Sources
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