- InChI
- InChI=1S/C23H32O4/c1-17(2)16-26-21(24)23(3,4)22(25)27-20(19-13-9-6-10-14-19)15-18-11-7-5-8-12-18/h6-7,9-11,13-14,17-18,20H,5,8,12,15-16H2,1-4H3
- InChI Key
- HIOIJAZHDPSNBD-UHFFFAOYSA-N
- Formula
- C23H32O4
- SMILES
-
CC(C)COC(=O)C(C)(C)C(=O)OC(CC1
C=CCCC1)c1ccccc1 - Molecular Weight1
- 372.50
- 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 | 0.7077 | Relay (1.0) Calculated Property | |
| ΔfG° | -160.28 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -798.72 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 33.54 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 99.69 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.67 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.74 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.243 | Crippen Calculated Property | |
| McVol | 310.890 | ml/mol | McGowan Calculated Property |
| Pc | 1344.71 | kPa | Joback Calculated Property |
| Inp | 2359.00 | NIST | |
| Tboil | 645.49 | K | Relay (1.0) Calculated Property |
| Tc | 873.52 | K | Relay (1.0) Calculated Property |
| Tfus | 309.51 | K | Relay (1.0) Calculated Property |
| Vc | 1.118 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1025.13; 1103.81] | J/mol×K | [919.50; 1147.79] | 
|
| Cp,gas | 1025.13 | J/mol×K | 919.50 | Joback Calculated Property |
| Cp,gas | 1041.89 | J/mol×K | 957.55 | Joback Calculated Property |
| Cp,gas | 1057.09 | J/mol×K | 995.60 | Joback Calculated Property |
| Cp,gas | 1070.80 | J/mol×K | 1033.64 | Joback Calculated Property |
| Cp,gas | 1083.10 | J/mol×K | 1071.69 | Joback Calculated Property |
| Cp,gas | 1094.08 | J/mol×K | 1109.74 | Joback Calculated Property |
| Cp,gas | 1103.81 | J/mol×K | 1147.79 | Joback Calculated Property |
| η | [0.0000253; 0.0006661] | Pa×s | [500.27; 919.50] |
|
| η | 0.0006661 | Pa×s | 500.27 | Joback Calculated Property |
| η | 0.0002764 | Pa×s | 570.14 | Joback Calculated Property |
| η | 0.0001390 | Pa×s | 640.01 | Joback Calculated Property |
| η | 0.0000800 | Pa×s | 709.88 | Joback Calculated Property |
| η | 0.0000508 | Pa×s | 779.76 | Joback Calculated Property |
| η | 0.0000348 | Pa×s | 849.63 | Joback Calculated Property |
| η | 0.0000253 | Pa×s | 919.50 | Joback Calculated Property |
Similar Compounds
Sources
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