AG00386E

216393-64-5 | 4-Bromo-2-fluorobenzeneboronic acid

AG00386E

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CAS Number	216393-64-5
Catalog Number	AG00386E(AGN-PC-0KKVCZ)
Chemical Name	4-Bromo-2-fluorobenzeneboronic acid
IUPAC Name	(4-bromo-2-fluorophenyl)boronic acid
InChI	InChI=1S/C6H5BBrFO2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3,10-11H
InChI Key	PKZHIIVZRPUZSU-UHFFFAOYSA-N
MDL Number	MFCD01318110
Molecular Formula	C6H5BBrFO2
Molecular Weight	218.8161
SMILES	BrC1=CC(=C(C=C1)B(O)O)F
Synonyms	4-Bromo-2-fluorobenzeneboronic acid, 216393-64-5, 4-Bromo-2-fluorophenylboronic acid, (4-bromo-2-fluorophenyl)boronic acid, 1-Borono-4-bromo-2-fluorobenzene, MFCD01318110, PubChem7778, AC1MCMSM, ACMC-209fms, SCHEMBL384996, CTK4E7377, DTXSID10378383, PKZHIIVZRPUZSU-UHFFFAOYSA-N, 4-Bromo-2-fluorobenzeneboronicacid, KS-00000O6N, ZX-AP000806, 4-bromo-2-fluoro-phenylboronic acid, 4-Bromo-2-fluorophenyl boronic acid, ANW-24530, PC4072, SBB095680, 4-bromo-2-fluoro-phenyl boronic acid, AKOS005258602, ZINC169747012, AB08626, AM86763, B1815G1, CB-4088, FCH1321718, LS11028, MCULE-2809580421, RP08728, RTC-068224, VB10675, AK-34116, BC000948, CC-18218, DS-12244, SC-02482, Boronic acid, (4-bromo-2-fluorophenyl)-, 4 - Bromo - 2 - fluorophenylboronic acid, AB0028537, AX8009868, Boronic acid,B-(4-bromo-2-fluorophenyl)-, DB-045648, TC-068224, (4-bromanyl-2-fluoranyl-phenyl)boronic acid, FT-0617770, ST24043387, X0626, 4-Bromo-2-fluorophenylboronic acid, AldrichCPR, A815557, C-11985, J-514656, I14-102488, C6H5BBrFO2, Bromo-2-fluorobenzeneboronic acid, (4-bromo-2-fluoro-phenyl)boronic Acid, CID2773333, A-4670,

Complexity	136
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	217.955g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	218.816g/mol
Monoisotopic Mass	217.955g/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	H302-H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

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