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53939-30-3

Basic Information
CAS No.: 53939-30-3
Name: 5-Bromo-2-chloropyridine
Article Data: 2
Molecular Structure:
Molecular Structure of 53939-30-3 (5-Bromo-2-chloropyridine)
Formula: C5H3BrClN
Molecular Weight: 192.443
Synonyms: 2-Chloro-5-bromopyridine;3-Bromo-6-chloropyridine;
EINECS: -0
Density: 1.736 g/cm3
Melting Point: 65-69 °C(lit.)
Boiling Point: 208.1 °C at 760 mmHg
Flash Point: 79.7 °C
Appearance: White crystal powder
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-36-37/39-36/37/39
PSA: 12.89000
LogP: 2.49750
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    53939-30-3

    5-Bromo-2-chloropyridine

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Specification

The 5-Bromo-2-chloropyridine is an organic compound with the formula C5H3BrClN. The IUPAC name of this chemical is 5-bromo-2-chloropyridine. With the CAS registry number 53939-30-3, it is also named as Pyridine, 5-bromo-2-chloro-. The product's categories are Compounds of Pyridine; Blocks; Bromides; Pyridines; Pyridine; Pyridine Derivative; Pyridine Series;Pyridines, Pyrimidines, Purines and Pteredines; Pyridines Derivates; Halogenated; Organohalides; Bromopyridines; Chloropyridines; Halopyridines; Boronic Acid; C5Heterocyclic Building Blocks; Halogenated Heterocycles; Heterocyclic Building Blocks; Variety of halogenated Heterocyclic Series. Besides, it is a white crystal powder, which should be stored in a closed cool and dry place.

Physical properties about 5-Bromo-2-chloropyridine are: (1)ACD/LogP: 2.36; (2)ACD/LogD (pH 5.5): 2.36; (3)ACD/LogD (pH 7.4): 2.36; (4)ACD/BCF (pH 5.5): 36.65; (5)ACD/BCF (pH 7.4): 36.65; (6)ACD/KOC (pH 5.5): 458.36; (7)ACD/KOC (pH 7.4): 458.36; (8)#H bond acceptors: 1; (9)Polar Surface Area: 12.89 Å2; (10)Index of Refraction: 1.581; (11)Molar Refractivity: 36.92 cm3; (12)Molar Volume: 110.7 cm3; (13)Polarizability: 14.63×10-24cm3; (14)Surface Tension: 45.5 dyne/cm; (15)Density: 1.736 g/cm3; (16)Flash Point: 79.7 °C; (17)Enthalpy of Vaporization: 42.62 kJ/mol; (18)Boiling Point: 208.1 °C at 760 mmHg; (19)Vapour Pressure: 0.313 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(ncc1Br)Cl
(2)InChI: InChI=1/C5H3BrClN/c6-4-1-2-5(7)8-3-4/h1-3H
(3)InChIKey: PEAOEIWYQVXZMB-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C5H3BrClN/c6-4-1-2-5(7)8-3-4/h1-3H
(5)Std. InChIKey: PEAOEIWYQVXZMB-UHFFFAOYSA-N