- InChI
- InChI=1S/C24H22O4/c1-3-17-9-7-11-19(15-17)27-23(25)21-13-5-6-14-22(21)24(26)28-20-12-8-10-18(4-2)16-20/h5-16H,3-4H2,1-2H3
- InChI Key
- XDUJERDZZZSVFY-UHFFFAOYSA-N
- Formula
- C24H22O4
- SMILES
-
CCc1cccc(OC(=O)c2ccccc2C(=O)Oc
2cccc(CC)c2)c1 - Molecular Weight1
- 374.44
- 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 | 0.9457 | Relay (1.0) Calculated Property | |
| ΔfG° | -161.20 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -460.37 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 47.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 121.61 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.22 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.84 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.250 | Crippen Calculated Property | |
| McVol | 292.620 | ml/mol | McGowan Calculated Property |
| Pc | 1521.12 | kPa | Joback Calculated Property |
| Inp | [2917.00; 2917.00] |
|
|
| Inp | 2917.00 | NIST | |
| Inp | 2917.00 | NIST | |
| Tboil | 698.07 | K | Relay (1.0) Calculated Property |
| Tc | 1003.30 | K | Relay (1.0) Calculated Property |
| Tfus | 331.21 | K | Relay (1.0) Calculated Property |
| Vc | 1.070 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [897.27; 945.60] | J/mol×K | [960.14; 1202.76] |
|
| Cp,gas | 897.27 | J/mol×K | 960.14 | Joback Calculated Property |
| Cp,gas | 909.19 | J/mol×K | 1000.58 | Joback Calculated Property |
| Cp,gas | 919.48 | J/mol×K | 1041.01 | Joback Calculated Property |
| Cp,gas | 928.20 | J/mol×K | 1081.45 | Joback Calculated Property |
| Cp,gas | 935.41 | J/mol×K | 1121.88 | Joback Calculated Property |
| Cp,gas | 941.19 | J/mol×K | 1162.32 | Joback Calculated Property |
| Cp,gas | 945.60 | J/mol×K | 1202.76 | Joback Calculated Property |
| η | [0.0000258; 0.0002950] | Pa×s | [561.72; 960.14] |
|
| η | 0.0002950 | Pa×s | 561.72 | Joback Calculated Property |
| η | 0.0001586 | Pa×s | 628.12 | Joback Calculated Property |
| η | 0.0000961 | Pa×s | 694.53 | Joback Calculated Property |
| η | 0.0000635 | Pa×s | 760.93 | Joback Calculated Property |
| η | 0.0000448 | Pa×s | 827.33 | Joback Calculated Property |
| η | 0.0000333 | Pa×s | 893.74 | Joback Calculated Property |
| η | 0.0000258 | Pa×s | 960.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phthalic acid, di(3-ethylphenyl) ester.
Sources
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