- InChI
- InChI=1S/C23H28O5/c1-4-15-26-21(24)23(5-2,6-3)22(25)27-17-18-11-10-14-20(16-18)28-19-12-8-7-9-13-19/h7-14,16H,4-6,15,17H2,1-3H3
- InChI Key
- QZLIUKIMWKFFFQ-UHFFFAOYSA-N
- Formula
- C23H28O5
- SMILES
-
CCCOC(=O)C(CC)(CC)C(=O)OCc1ccc
c(Oc2ccccc2)c1 - Molecular Weight1
- 384.47
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.8998 | Relay (1.0) Calculated Property | |
| ΔfG° | -212.03 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -761.52 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 42.37 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 110.26 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.13 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.37 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.282 | Crippen Calculated Property | |
| McVol | 308.160 | ml/mol | McGowan Calculated Property |
| Pc | 1387.11 | kPa | Joback Calculated Property |
| Inp | 2626.00 | NIST | |
| Tboil | 682.57 | K | Relay (1.0) Calculated Property |
| Tc | 917.58 | K | Relay (1.0) Calculated Property |
| Tfus | 302.94 | K | Relay (1.0) Calculated Property |
| Vc | 1.093 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [984.93; 1047.35] | J/mol×K | [955.75; 1183.43] | 
|
| Cp,gas | 984.93 | J/mol×K | 955.75 | Joback Calculated Property |
| Cp,gas | 998.69 | J/mol×K | 993.70 | Joback Calculated Property |
| Cp,gas | 1011.03 | J/mol×K | 1031.64 | Joback Calculated Property |
| Cp,gas | 1022.01 | J/mol×K | 1069.59 | Joback Calculated Property |
| Cp,gas | 1031.68 | J/mol×K | 1107.54 | Joback Calculated Property |
| Cp,gas | 1040.11 | J/mol×K | 1145.48 | Joback Calculated Property |
| Cp,gas | 1047.35 | J/mol×K | 1183.43 | Joback Calculated Property |
| η | [0.0000209; 0.0002296] | Pa×s | [583.30; 955.75] |
|
| η | 0.0002296 | Pa×s | 583.30 | Joback Calculated Property |
| η | 0.0001270 | Pa×s | 645.38 | Joback Calculated Property |
| η | 0.0000780 | Pa×s | 707.45 | Joback Calculated Property |
| η | 0.0000518 | Pa×s | 769.53 | Joback Calculated Property |
| η | 0.0000365 | Pa×s | 831.60 | Joback Calculated Property |
| η | 0.0000271 | Pa×s | 893.67 | Joback Calculated Property |
| η | 0.0000209 | Pa×s | 955.75 | Joback Calculated Property |
Similar Compounds
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Sources
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