- InChI
- InChI=1S/C22H26O4/c1-15-9-7-11-19(17(15)3)25-21(23)13-5-6-14-22(24)26-20-12-8-10-16(2)18(20)4/h7-12H,5-6,13-14H2,1-4H3
- InChI Key
- HOAZLBPACVBNRI-UHFFFAOYSA-N
- Formula
- C22H26O4
- SMILES
-
Cc1cccc(OC(=O)CCCCC(=O)Oc2cccc
(C)c2C)c1C - Molecular Weight1
- 354.44
- 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° | -147.18 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -559.83 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 44.84 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 90.08 | kJ/mol | Joback Calculated Property |
| log10WS | -6.49 | Crippen Calculated Property | |
| logPoct/wat | 4.992 | Crippen Calculated Property | |
| McVol | 288.200 | ml/mol | McGowan Calculated Property |
| Pc | 1439.16 | kPa | Joback Calculated Property |
| Inp | 2862.00 | NIST | |
| Tboil | 928.62 | K | Joback Calculated Property |
| Tc | 1152.72 | K | Joback Calculated Property |
| Tfus | 584.94 | K | Joback Calculated Property |
| Vc | 1.099 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [894.60; 958.43] | J/mol×K | [928.62; 1152.72] | 
|
| Cp,gas | 894.60 | J/mol×K | 928.62 | Joback Calculated Property |
| Cp,gas | 908.60 | J/mol×K | 965.97 | Joback Calculated Property |
| Cp,gas | 921.22 | J/mol×K | 1003.32 | Joback Calculated Property |
| Cp,gas | 932.49 | J/mol×K | 1040.67 | Joback Calculated Property |
| Cp,gas | 942.43 | J/mol×K | 1078.02 | Joback Calculated Property |
| Cp,gas | 951.07 | J/mol×K | 1115.37 | Joback Calculated Property |
| Cp,gas | 958.43 | J/mol×K | 1152.72 | Joback Calculated Property |
| η | [0.0000451; 0.0002974] | Pa×s | [584.94; 928.62] |
|
| η | 0.0002974 | Pa×s | 584.94 | Joback Calculated Property |
| η | 0.0001888 | Pa×s | 642.22 | Joback Calculated Property |
| η | 0.0001291 | Pa×s | 699.50 | Joback Calculated Property |
| η | 0.0000935 | Pa×s | 756.78 | Joback Calculated Property |
| η | 0.0000709 | Pa×s | 814.06 | Joback Calculated Property |
| η | 0.0000557 | Pa×s | 871.34 | Joback Calculated Property |
| η | 0.0000451 | Pa×s | 928.62 | Joback Calculated Property |
Similar Compounds
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Sources
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