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| CAS No.: | 831203-13-5 |
|---|---|
| Name: | 5-Bromo-2-chloro-3-fluoropyridine |
| Article Data: | 2 |
| Molecular Structure: | |
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| Formula: | C5H2BrClFN |
| Molecular Weight: | 210.433 |
| Synonyms: | Pyridine,5-bromo-2-chloro-3-fluoro- |
| Density: | 1.829 g/cm3 |
| Melting Point: | 50-52℃ |
| Boiling Point: | 195.3 °C at 760 mmHg |
| Flash Point: | 71.9 °C |
| Appearance: | White solid |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 22-37/38-41 |
| Safety: | 26-39 |
| PSA: | 12.89000 |
| LogP: | 2.63660 |
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Specification
The 5-Bromo-2-chloro-3-fluoropyridine is an organic compound with the formula C5H2BrClFN. The IUPAC name of this chemical is 5-bromo-2-chloro-3-fluoropyridine. With the CAS registry number 831203-13-5, it is also named as Pyridine, 5-bromo-2-chloro-3-fluoro-. The product's category is Boronic Acid. Besides, it is often used as pharmaceutical intermediates and raw herbs.
Physical properties about 5-Bromo-2-chloro-3-fluoropyridine are: (1)ACD/LogP: 2.50; (2)ACD/LogD (pH 5.5): 2.5; (3)ACD/LogD (pH 7.4): 2.5; (4)ACD/BCF (pH 5.5): 46.93; (5)ACD/BCF (pH 7.4): 46.93; (6)ACD/KOC (pH 5.5): 547.03; (7)ACD/KOC (pH 7.4): 547.03; (8)#H bond acceptors: 1; (9)Polar Surface Area: 12.89 Å2; (10)Index of Refraction: 1.555; (11)Molar Refractivity: 36.92 cm3; (12)Molar Volume: 115 cm3; (13)Polarizability: 14.63×10-24cm3; (14)Surface Tension: 43.2 dyne/cm; (15)Density: 1.829 g/cm3; (16)Flash Point: 71.9 °C; (17)Enthalpy of Vaporization: 41.38 kJ/mol; (18)Boiling Point: 195.3 °C at 760 mmHg; (19)Vapour Pressure: 0.592 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc1cnc(Cl)c(F)c1
(2)InChI: InChI=1/C5H2BrClFN/c6-3-1-4(8)5(7)9-2-3/h1-2H
(3)InChIKey: OEKXUEWGXWCENG-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C5H2BrClFN/c6-3-1-4(8)5(7)9-2-3/h1-2H
(5)Std. InChIKey: OEKXUEWGXWCENG-UHFFFAOYSA-N