- InChI
- InChI=1S/C16H14O3/c1-11(17)13-3-7-15(8-4-13)19-16-9-5-14(6-10-16)12(2)18/h3-10H,1-2H3
- InChI Key
- GZRGHDIUPMPHCB-UHFFFAOYSA-N
- Formula
- C16H14O3
- SMILES
-
CC(=O)c1ccc(Oc2ccc(C(C)=O)cc2)
cc1 - Molecular Weight1
- 254.29
- 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).
- 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 | 0.7088 | Relay (1.0) Calculated Property | |
| ΔfG° | -73.44 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -334.36 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 28.89 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 99.59 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.21 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.31 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.884 | Crippen Calculated Property | |
| McVol | 197.790 | ml/mol | McGowan Calculated Property |
| Pc | 2467.81 | kPa | Joback Calculated Property |
| Tboil | 632.93 | K | Relay (1.0) Calculated Property |
| Tc | 904.98 | K | Relay (1.0) Calculated Property |
| Tfus | 398.74 | K | Relay (1.0) Calculated Property |
| Vc | 0.725 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [531.52; 598.02] | J/mol×K | [759.16; 999.12] | 
|
| Cp,gas | 531.52 | J/mol×K | 759.16 | Joback Calculated Property |
| Cp,gas | 545.42 | J/mol×K | 799.15 | Joback Calculated Property |
| Cp,gas | 558.13 | J/mol×K | 839.15 | Joback Calculated Property |
| Cp,gas | 569.71 | J/mol×K | 879.14 | Joback Calculated Property |
| Cp,gas | 580.19 | J/mol×K | 919.13 | Joback Calculated Property |
| Cp,gas | 589.61 | J/mol×K | 959.13 | Joback Calculated Property |
| Cp,gas | 598.02 | J/mol×K | 999.12 | Joback Calculated Property |
| η | [0.0001234; 0.0008599] | Pa×s | [470.05; 759.16] |
|
| η | 0.0008599 | Pa×s | 470.05 | Joback Calculated Property |
| η | 0.0005354 | Pa×s | 518.24 | Joback Calculated Property |
| η | 0.0003613 | Pa×s | 566.42 | Joback Calculated Property |
| η | 0.0002593 | Pa×s | 614.61 | Joback Calculated Property |
| η | 0.0001953 | Pa×s | 662.79 | Joback Calculated Property |
| η | 0.0001529 | Pa×s | 710.97 | Joback Calculated Property |
| η | 0.0001234 | Pa×s | 759.16 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Acetylphenyl ether.
Sources
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