AG004NJ1

870459-91-9 | 4-Chloropyridine-2-boronic acid

AG004NJ1

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CAS Number	870459-91-9
Catalog Number	AG004NJ1(AGN-PC-0BKEVG)
Chemical Name	4-Chloropyridine-2-boronic acid
IUPAC Name	(4-chloropyridin-2-yl)boronic acid
InChI	InChI=1S/C5H5BClNO2/c7-4-1-2-8-5(3-4)6(9)10/h1-3,9-10H
InChI Key	KOLVACJGJSSBEM-UHFFFAOYSA-N
MDL Number	MFCD12401036
Molecular Formula	C5H5BClNO2
Molecular Weight	157.3627
SMILES	ClC1=CC(B(O)O)=NC=C1
Synonyms	(4-Chloropyridin-2-yl)boronic acid, 870459-91-9, 4-Chloropyridine-2-boronic acid, 4-chloropyridin-2-ylboronic acid, Boronic acid, (4-chloro-2-pyridinyl)-, AK-81399, SCHEMBL4484450, CTK8B4926, KS-00000POC, DTXSID40718874, ANW-46730, MFCD12401036, AKOS015998701, ZINC169746100, FCH1152953, RL05399, OR360128, AX8225383, TX-010325, 4CH-004727, FT-0645469, ST24020551, W8932, A-9243, C5H5BClNO2, 6-Chloropyridin-2-ylboronic acid, 6-CHLOROPYRIDINE-2-BORONIC ACID, N/A,

Complexity	114
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	157.01g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	157.36g/mol
Monoisotopic Mass	157.01g/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	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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