AG006NKK

913835-65-1 | Boronicacid, B-4-pyridinyl-, hydrochloride (1:1)

AG006NKK

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CAS Number	913835-65-1
Catalog Number	AG006NKK(AGN-PC-0VS7DI)
Chemical Name	Boronicacid, B-4-pyridinyl-, hydrochloride (1:1)
IUPAC Name	pyridin-4-ylboronic acid;hydrochloride
InChI	InChI=1S/C5H6BNO2.ClH/c8-6(9)5-1-3-7-4-2-5;/h1-4,8-9H;1H
InChI Key	NCZXYQJUECNKAD-UHFFFAOYSA-N
MDL Number	MFCD06201888
Molecular Formula	C5H7BClNO2
Molecular Weight	159.3786
SMILES	OB(c1ccncc1)O.Cl
Synonyms	913835-65-1, Pyridine-4-boronic acid hydrochloride, pyridin-4-ylboronic acid hydrochloride, pyridine-4-boronic acid, hcl, 4-pyridineboronic acid, hydrochloride, Pyridine-4-boronic acid HCl, Boronicacid, B-4-pyridinyl-, hydrochloride (1:1), MFCD06201888, C5H6BNO2.HCl, pyridineboronic acid, 4-, hcl, SCHEMBL15110156, CTK3I6443, DTXSID90656959, NCZXYQJUECNKAD-UHFFFAOYSA-N, 4-pyridineboronic acid,hydrochloride, ZX-AT004808, ANW-43605, AKOS015894216, AB23111, OR14161, RTR-028659, VP14745, KS-000011L7, (pyridin-4-yl)boronic acid hydrochloride, AS-18074, pyridine-4-boronic acid-hydrogen chloride, 4-(dihydroxyboranyl)pyridin-1-ium chloride, TR-028659, FT-0687755, V9019, B-5099, Boronicacid,b-4-pyridinyl-,hydrochloride(1:1), pyridine-4-boronic acid hydrochloride, AldrichCPR, I04-6899, Pyridin-4-ylboronic acid--hydrogen chloride (1/1), pyridin-4-ylboronic acid;hydrochloride, ACN-044156, 1692-15-5,

Complexity	83
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	159.026g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	159.376g/mol
Monoisotopic Mass	159.026g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	53.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P280a-P304+P340-P305+P351+P338-P405-P501a
UN Code

Certificate of Analysis

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