AG006BSI

957035-17-5 | (3,4-Dichloro-2-methylphenyl)boronic acid

AG006BSI

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CAS Number	957035-17-5
Catalog Number	AG006BSI(AGN-PC-0W5C7R)
Chemical Name	(3,4-Dichloro-2-methylphenyl)boronic acid
IUPAC Name	(3,4-dichloro-2-methylphenyl)boronic acid
InChI	InChI=1S/C7H7BCl2O2/c1-4-5(8(11)12)2-3-6(9)7(4)10/h2-3,11-12H,1H3
InChI Key	FQMLZXAQSIOVFD-UHFFFAOYSA-N
MDL Number	MFCD09475873
Molecular Formula	C7H7BCl2O2
Molecular Weight	204.8463
SMILES	CC1=C(Cl)C(Cl)=CC=C1B(O)O
Synonyms	957035-17-5, (3,4-Dichloro-2-methylphenyl)boronic acid, 3,4-DICHLORO-2-METHYLPHENYLBORONIC ACID, AK-92802, ACMC-209s0t, SCHEMBL14120507, CTK5H7986, DTXSID40656984, FQMLZXAQSIOVFD-UHFFFAOYSA-N, ZX-AT019653, ANW-40587, MFCD09475873, AKOS015848443, ZINC169746409, FCH1323704, OR11475, RTR-029866, KS-00000Q09, 3,4-Dichloro-2-methylbenzeneboronic acid, BP-12156, DS-17694, 3,4-dichloro-2-methyl-benzeneboronic acid, AX8230662, TR-029866, ST24020296, V9672, B-5127, I04-2528, C7H7BCl2O2, 3,4-Dichloro-2-methylphenylboronicacid, (3,4-Dichloro-2-methylphenyl)boronicacid,

Complexity	156
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	203.992g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	204.841g/mol
Monoisotopic Mass	203.992g/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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