![3-(3-[Trifluoromethyl]phenoxy)benzaldehyde](/cid/117-526-8/3-3-Trifluoromethyl-phenoxy-benzaldehyde.png "3-(3-[Trifluoromethyl]phenoxy)benzaldehyde")
- InChI
- InChI=1S/C14H9F3O2/c15-14(16,17)11-4-2-6-13(8-11)19-12-5-1-3-10(7-12)9-18/h1-9H
- InChI Key
- RPORRWJOHNQOHN-UHFFFAOYSA-N
- Formula
- C14H9F3O2
- SMILES
-
O=Cc1cccc(Oc2cccc(C(F)(F)F)c2)
c1 - Molecular Weight1
- 266.22
- CAS
- 78725-46-9
- Other Names
-
- Benzaldehyde, 3-[3-(trifluoromethyl)phenoxy]-
- 3-(3'-trifluoromethyl)phenoxy)benzaldehyde
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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 | 0.5904 | Relay (1.0) Calculated Property | |
| ΔfG° | -513.55 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -742.02 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 24.62 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.41 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.82 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.55 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.310 | Crippen Calculated Property | |
| McVol | 173.350 | ml/mol | McGowan Calculated Property |
| Pc | 2527.73 | kPa | Joback Calculated Property |
| Tboil | 587.52 | K | Relay (1.0) Calculated Property |
| Tc | 837.81 | K | Relay (1.0) Calculated Property |
| Tfus | 337.17 | K | Relay (1.0) Calculated Property |
| Vc | 0.622 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [442.13; 505.99] | J/mol×K | [648.70; 868.89] | 
|
| Cp,gas | 442.13 | J/mol×K | 648.70 | Joback Calculated Property |
| Cp,gas | 455.16 | J/mol×K | 685.40 | Joback Calculated Property |
| Cp,gas | 467.16 | J/mol×K | 722.10 | Joback Calculated Property |
| Cp,gas | 478.18 | J/mol×K | 758.80 | Joback Calculated Property |
| Cp,gas | 488.29 | J/mol×K | 795.50 | Joback Calculated Property |
| Cp,gas | 497.54 | J/mol×K | 832.20 | Joback Calculated Property |
| Cp,gas | 505.99 | J/mol×K | 868.89 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-(3-[Trifluoromethyl]phenoxy)benzaldehyde.
Sources
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