AG004S9M

850568-71-7 | Quinoline-3-boronic acid, HCl

AG004S9M

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CAS Number	850568-71-7
Catalog Number	AG004S9M(AGN-PC-0UX3LT)
Chemical Name	Quinoline-3-boronic acid, HCl
IUPAC Name	quinolin-3-ylboronic acid;hydrochloride
InChI	InChI=1S/C9H8BNO2.ClH/c12-10(13)8-5-7-3-1-2-4-9(7)11-6-8;/h1-6,12-13H;1H
InChI Key	BQFQABXCFQWPGH-UHFFFAOYSA-N
MDL Number	MFCD06659836
Molecular Formula	C9H9BClNO2
Molecular Weight	209.4373
SMILES	N1C2C(=CC=CC=2)C=C(B(O)O)C=1.Cl
Synonyms	850568-71-7, quinolin-3-ylboronic acid hydrochloride, Quinoline-3-boronic acid hydrochloride, Quinoline-3-boronic acid, HCl, 3-QUINOLINEBORONIC ACID HYDROCHLORIDE, MFCD06659836, Quinoline-3-boronic acid,hydrochloride, PubChem5872, Quinoline-3-boronic acid HCl, CTK8B3989, DTXSID10656976, ZX-AT010002, 3-QUINOLINEBORONIC ACID, HCL, ANW-43608, OR1932, 3-quinolinylboronic acid hydrochloride, AKOS016001509, AB26441, RTR-026531, AX8089176, quinoline-3-boronic acid hydrochloride 97%, TR-026531, X2443, B-5067, A841133, Quinolin-3-ylboronic acid--hydrogen chloride (1/1), C9H9BClNO2,

Complexity	177
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	209.041g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	209.436g/mol
Monoisotopic Mass	209.041g/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

Lot Number