CAS No.1072945-98-2,2-Chloro-5-methoxypyridine-4-boronic acid Suppliers

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Basic Information

Molecular Structure:
CAS No.:	1072945-98-2
Name:	2-Chloro-5-methoxypyridine-4-boronic acid

Formula:	C₆H₇BClNO₃
Molecular Weight:	187.39
Synonyms:	(2-Chloro-5-methoxypyridin-4-yl)boronic acid;2-Chloro-5-methoxypyridin-4-ylboronic acid;
Density:	1.403 g/cm³
Boiling Point:	399.649 °C at 760 mmHg
Flash Point:	195.501 °C
PSA:	62.58000
LogP:	-0.57660

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Specification

The 2-Chloro-5-methoxypyridine-4-boronic acid, with the CAS registry number 1072945-98-2, is also known as (2-Chloro-5-methoxypyridin-4-yl)boronic acid. This chemical's molecular formula is C₆H₇BClNO₃ and molecular weight is 187.3887. What's more, its systematic name is Boronic acid, B-(2-chloro-5-methoxy-4-pyridinyl)-.

Physical properties about 2-Chloro-5-methoxypyridine-4-boronic acid are: (1)ACD/LogP: 0.86; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 2.43; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 64.274; (6)ACD/KOC (pH 7.4): 9.333; (7)#H bond acceptors: 4; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 62.58 Å²; (11)Index of Refraction: 1.546; (12)Molar Refractivity: 42.279 cm³; (13)Molar Volume: 133.589 cm³; (14)Polarizability: 16.761×10^-24 cm³; (15)Surface Tension: 54.525 dyne/cm; (16)Density: 1.403 g/cm³; (17)Flash Point: 195.501 °C; (18)Enthalpy of Vaporization: 68.589 kJ/mol; (19)Boiling Point: 399.649 °C at 760 mmHg; (20)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: B(c1cc(ncc1OC)Cl)(O)O
(2) InChI: InChI=1/C6H7BClNO3/c1-12-5-3-9-6(8)2-4(5)7(10)11/h2-3,10-11H,1H3
(3) InChIKey: RIJYQJUSSTXMRQ-UHFFFAOYAX