AG00C0NN

374790-99-5 | 4-Bromo-2,3-difluorobenzeneboronic acid

AG00C0NN

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CAS Number	374790-99-5
Catalog Number	AG00C0NN(AGN-PC-0KKVBU)
Chemical Name	4-Bromo-2,3-difluorobenzeneboronic acid
IUPAC Name	(4-bromo-2,3-difluorophenyl)boronic acid
InChI	InChI=1S/C6H4BBrF2O2/c8-4-2-1-3(7(11)12)5(9)6(4)10/h1-2,11-12H
InChI Key	CUTKSWXGYLUSCY-UHFFFAOYSA-N
MDL Number	MFCD02093065
Molecular Formula	C6H4BBrF2O2
Molecular Weight	236.8066
SMILES	OB(O)C1=C(F)C(F)=C(Br)C=C1
Synonyms	4-Bromo-2,3-difluorophenylboronic acid, 374790-99-5, 4-bromo-2,3-difluorobenzeneboronic acid, (4-bromo-2,3-difluorophenyl)boronic acid, 4-Borono-1-bromo-2,3-difluorobenzene, (4-bromo-2,3-difluorophenyl)-boronic acid, PubChem7777, AC1MCMQG, ACMC-209ita, SCHEMBL257742, CTK4H8242, DTXSID70378344, CUTKSWXGYLUSCY-UHFFFAOYSA-N, ANW-28652, CB-269, MFCD02093065, SBB098692, AKOS005257725, ZINC169747009, AB10750, AS04980, MCULE-7457286691, RTR-015208, VB10674, AS-55591, B280, BC000923, 4-Bromo-2,3-Difluoro phenyl boronic acid, DB-010657, TL8002757, TR-015208, 4CH-000997, A6405, CS-0060311, FT-0617736, X0758, A-4626, Boronic acid,B-(4-bromo-2,3-difluorophenyl)-, C6H4BBrF2O2, 3-Chloro-4-fluorophenylboronicacid, ACN-056636, CID2773292, (4-bromo-2,3-difluoro-phenyl)boronic Acid, Boronic acid, (4-bromo-2,3-difluorophenyl)- (9CI), (1-(5-CARBOXYPENTYL)-3,3-DIMETHYL-3H-INDOL-1-IUM-2-YL)METHANIDE HYDROBROMIDE,

Complexity	161
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	235.946g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	236.807g/mol
Monoisotopic Mass	235.946g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	40.5A^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-P305+P351+P338
UN Code

Certificate of Analysis

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