- InChI
- InChI=1S/C13H10BrClN2/c14-10-1-5-12(6-2-10)16-9-17-13-7-3-11(15)4-8-13/h1-9H,(H,16,17)
- InChI Key
- RIEPTEQGPPLMPB-UHFFFAOYSA-N
- Formula
- C13H10BrClN2
- SMILES
- Clc1ccc(NC=Nc2ccc(Br)cc2)cc1
- Molecular Weight1
- 309.59
- 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 | 0.5999 | Relay (1.0) Calculated Property | |
| ΔfG° | 342.55 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 242.45 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 101.23 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.17 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.38 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.874 | Crippen Calculated Property | |
| McVol | 191.910 | ml/mol | McGowan Calculated Property |
| Pc | 2787.66 | kPa | Joback Calculated Property |
| Inp | [2535.00; 2535.00] |
|
|
| Inp | 2535.00 | NIST | |
| Inp | 2535.00 | NIST | |
| Tboil | 654.90 | K | Relay (1.0) Calculated Property |
| Tc | 938.31 | K | Relay (1.0) Calculated Property |
| Tfus | 427.24 | K | Relay (1.0) Calculated Property |
| Vc | 0.662 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to N-(4-Chlorophenyl)-N'-(4-bromophenyl)formamidine.
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
- Joback Method
- McGowan Method
- NIST Webbook
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