- InChI
- InChI=1S/C24H22O5/c1-2-14-27-23(25)19-9-7-10-20(16-19)24(26)28-17-18-8-6-13-22(15-18)29-21-11-4-3-5-12-21/h3-13,15-16H,2,14,17H2,1H3
- InChI Key
- KOAQQBQSRVYZRL-UHFFFAOYSA-N
- Formula
- C24H22O5
- SMILES
-
CCCOC(=O)c1cccc(C(=O)OCc2cccc(
Oc3ccccc3)c2)c1 - Molecular Weight1
- 390.43
- 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° | -103.67 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -473.86 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 46.02 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 97.89 | kJ/mol | Joback Calculated Property |
| log10WS | -6.54 | Crippen Calculated Property | |
| logPoct/wat | 5.403 | Crippen Calculated Property | |
| McVol | 298.490 | ml/mol | McGowan Calculated Property |
| Pc | 1620.68 | kPa | Joback Calculated Property |
| Inp | 3147.00 | NIST | |
| Tboil | 1013.52 | K | Joback Calculated Property |
| Tc | 1258.54 | K | Joback Calculated Property |
| Tfus | 631.09 | K | Joback Calculated Property |
| Vc | 1.121 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [933.31; 973.68] | J/mol×K | [1013.52; 1258.54] | 
|
| Cp,gas | 933.31 | J/mol×K | 1013.52 | Joback Calculated Property |
| Cp,gas | 944.01 | J/mol×K | 1054.36 | Joback Calculated Property |
| Cp,gas | 953.06 | J/mol×K | 1095.19 | Joback Calculated Property |
| Cp,gas | 960.50 | J/mol×K | 1136.03 | Joback Calculated Property |
| Cp,gas | 966.39 | J/mol×K | 1176.87 | Joback Calculated Property |
| Cp,gas | 970.76 | J/mol×K | 1217.70 | Joback Calculated Property |
| Cp,gas | 973.68 | J/mol×K | 1258.54 | Joback Calculated Property |
| η | [0.0000251; 0.0001945] | Pa×s | [631.09; 1013.52] |
|
| η | 0.0001945 | Pa×s | 631.09 | Joback Calculated Property |
| η | 0.0001182 | Pa×s | 694.83 | Joback Calculated Property |
| η | 0.0000781 | Pa×s | 758.57 | Joback Calculated Property |
| η | 0.0000550 | Pa×s | 822.31 | Joback Calculated Property |
| η | 0.0000408 | Pa×s | 886.04 | Joback Calculated Property |
| η | 0.0000315 | Pa×s | 949.78 | Joback Calculated Property |
| η | 0.0000251 | Pa×s | 1013.52 | Joback Calculated Property |
Similar Compounds
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Sources
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