AG00BECZ

221006-71-9 | 4-Bromo-2-methylphenylboronic acid

AG00BECZ

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CAS Number	221006-71-9
Catalog Number	AG00BECZ(AGN-PC-0WAA2X)
Chemical Name	4-Bromo-2-methylphenylboronic acid
IUPAC Name	(4-bromo-2-methylphenyl)boronic acid
InChI	InChI=1S/C7H8BBrO2/c1-5-4-6(9)2-3-7(5)8(10)11/h2-4,10-11H,1H3
InChI Key	BEQUDVVISBTSHZ-UHFFFAOYSA-N
MDL Number	MFCD16660270
Molecular Formula	C7H8BBrO2
Molecular Weight	214.8522
SMILES	CC1=C(C=CC(Br)=C1)B(O)O
Synonyms	221006-71-9, (4-Bromo-2-methylphenyl)boronic acid, 4-BROMO-2-METHYLPHENYLBORONIC ACID, AK-85377, ACMC-209fs0, SCHEMBL9848214, CTK4E8568, DTXSID10431184, BEQUDVVISBTSHZ-UHFFFAOYSA-N, 4-Bromo-2-methylphenyboronic acid, KS-000026BI, ANW-24718, AKOS015835525, ZINC169747853, AB71470, FCH1346948, GS-6515, OR360799, AX8240013, TR-036172, ST24034617, X0634, A-4728, I04-1763, C7H8BBrO2, (4-Bromo-2-methylphenyl)boronicacid, (4-bromo-2-methyl-phenyl)boronic Acid, CID9815779,

Complexity	132
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	213.98g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	214.853g/mol
Monoisotopic Mass	213.98g/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-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number