CAS No.127561-70-0,2-BROMO-3-HYDROXY-5-CHLOROPYRIDINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	127561-70-0
Name:	2-BROMO-3-HYDROXY-5-CHLOROPYRIDINE
Article Data:	3

Formula:	C₅H₃BrClNO
Molecular Weight:	208.442
Synonyms:	2-Bromo-5-chloro-3-hydroxypyridine;2-Bromo-5-chloro-3-pyridinol;
Density:	1.908g/cm³
Boiling Point:	326.1 °C at 760 mmHg
Flash Point:	151 °C
PSA:	33.12000
LogP:	2.20310

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Specification

The 3-Pyridinol,2-bromo-5-chloro-, with CAS registry number 127561-70-0, belongs to the following product category: Pyridine. It has the systematic name of 2-bromo-5-chloropyridin-3-ol. Besides this, it is also called 2-Bromo-3-hydroxy-5-chloropyridine. And the chemical formula of this chemical is C₅H₃BrClNO.

Physical properties of 3-Pyridinol,2-bromo-5-chloro-: (1)ACD/LogP: 2.77; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.6; (4)ACD/LogD (pH 7.4): 1.19; (5)ACD/BCF (pH 5.5): 50.64; (6)ACD/BCF (pH 7.4): 1.99; (7)ACD/KOC (pH 5.5): 517.9; (8)ACD/KOC (pH 7.4): 20.4; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 33.12 Å²; (13)Index of Refraction: 1.628; (14)Molar Refractivity: 38.81 cm³; (15)Molar Volume: 109.2 cm³; (16)Polarizability: 15.38×10^-24cm³; (17)Surface Tension: 59 dyne/cm; (18)Density: 1.908 g/cm³; (19)Flash Point: 151 °C; (20)Enthalpy of Vaporization: 59.09 kJ/mol; (21)Boiling Point: 326.1 °C at 760 mmHg; (22)Vapour Pressure: 0.000116 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cnc(Br)c(O)c1
(2)InChI: InChI=1/C5H3BrClNO/c6-5-4(9)1-3(7)2-8-5/h1-2,9H
(3)InChIKey: CXEWQBDKAZUKBB-UHFFFAOYAX