- InChI
- InChI=1S/C19H12F4N2O2/c20-13-7-9-14(10-8-13)24-18(26)16-5-2-6-17(25-16)27-15-4-1-3-12(11-15)19(21,22)23/h1-11H,(H,24,26)
- InChI Key
- CWKFPEBMTGKLKX-UHFFFAOYSA-N
- Formula
- C19H12F4N2O2
- SMILES
-
O=C(Nc1ccc(F)cc1)c1cccc(Oc2ccc
c(C(F)(F)F)c2)n1 - Molecular Weight1
- 376.30
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation 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 | 0.7842 | Relay (1.0) Calculated Property | |
| ΔfG° | -521.69 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -843.75 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 109.95 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.19 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.99 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.284 | Crippen Calculated Property | |
| McVol | 241.770 | ml/mol | McGowan Calculated Property |
| Pc | 2269.97 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [2477.00; 2483.00] |
|
|
| Inp | 2483.00 | NIST | |
| Inp | 2477.00 | NIST | |
| Tboil | 690.58 | K | Relay (1.0) Calculated Property |
| Tc | 1003.76 | K | Relay (1.0) Calculated Property |
| Tfus | 431.41 | K | Relay (1.0) Calculated Property |
| Vc | 0.871 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Picolinafen.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- McGowan Method
- NIST Webbook
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