- InChI
- InChI=1S/C22H26O5/c1-2-15-25-21(23)13-6-7-14-22(24)26-17-18-9-8-12-20(16-18)27-19-10-4-3-5-11-19/h3-5,8-12,16H,2,6-7,13-15,17H2,1H3
- InChI Key
- LBAXFHWAYMBSTD-UHFFFAOYSA-N
- Formula
- C22H26O5
- SMILES
-
CCCOC(=O)CCCCC(=O)OCc1cccc(Oc2
ccccc2)c1 - Molecular Weight1
- 370.44
- 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° | -223.29 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -657.64 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 47.19 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 90.50 | kJ/mol | Joback Calculated Property |
| log10WS | -5.48 | Crippen Calculated Property | |
| logPoct/wat | 5.036 | Crippen Calculated Property | |
| McVol | 294.070 | ml/mol | McGowan Calculated Property |
| Pc | 1470.23 | kPa | Joback Calculated Property |
| Inp | 2778.00 | NIST | |
| Tboil | 936.10 | K | Joback Calculated Property |
| Tc | 1158.31 | K | Joback Calculated Property |
| Tfus | 569.61 | K | Joback Calculated Property |
| Vc | 1.117 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [925.35; 985.53] | J/mol×K | [936.10; 1158.31] | 
|
| Cp,gas | 925.35 | J/mol×K | 936.10 | Joback Calculated Property |
| Cp,gas | 938.87 | J/mol×K | 973.14 | Joback Calculated Property |
| Cp,gas | 950.95 | J/mol×K | 1010.17 | Joback Calculated Property |
| Cp,gas | 961.63 | J/mol×K | 1047.21 | Joback Calculated Property |
| Cp,gas | 970.94 | J/mol×K | 1084.24 | Joback Calculated Property |
| Cp,gas | 978.89 | J/mol×K | 1121.28 | Joback Calculated Property |
| Cp,gas | 985.53 | J/mol×K | 1158.31 | Joback Calculated Property |
| η | [0.0000316; 0.0002967] | Pa×s | [569.61; 936.10] |
|
| η | 0.0002967 | Pa×s | 569.61 | Joback Calculated Property |
| η | 0.0001706 | Pa×s | 630.69 | Joback Calculated Property |
| η | 0.0001081 | Pa×s | 691.77 | Joback Calculated Property |
| η | 0.0000738 | Pa×s | 752.86 | Joback Calculated Property |
| η | 0.0000533 | Pa×s | 813.94 | Joback Calculated Property |
| η | 0.0000403 | Pa×s | 875.02 | Joback Calculated Property |
| η | 0.0000316 | Pa×s | 936.10 | Joback Calculated Property |
Similar Compounds
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Sources
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