AG004FEH

879275-70-4 | Boronic acid,B-[2-(difluoromethyl)phenyl]-

AG004FEH

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CAS Number	879275-70-4
Catalog Number	AG004FEH(AGN-PC-0VHOPU)
Chemical Name	Boronic acid,B-[2-(difluoromethyl)phenyl]-
IUPAC Name	[2-(difluoromethyl)phenyl]boronic acid
InChI	InChI=1S/C7H7BF2O2/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4,7,11-12H
InChI Key	RTUHFDBTYFIWMU-UHFFFAOYSA-N
MDL Number	MFCD09864669
Molecular Formula	C7H7BF2O2
Molecular Weight	171.9371
SMILES	FC(C1=CC=CC=C1B(O)O)F
Synonyms	879275-70-4, 2-Difluoromethyl-phenylboronic acid, (2-(difluoromethyl)phenyl)boronic acid, 2-(difluoromethyl)phenylboronic acid, Boronic acid,B-[2-(difluoromethyl)phenyl]-, [2-(difluoromethyl)phenyl]boronic acid, SCHEMBL4013443, CTK5F9163, DTXSID90660132, 2-Difluoromethylphenylboronic acid, RTUHFDBTYFIWMU-UHFFFAOYSA-N, ZX-AP011824, MFCD09864669, SBB088559, 2-(Difluoromethyl)benzeneboronic acid, AKOS015852890, ZINC197964753, FCH1152701, Boronic acid, B-[2-(difluoromethyl)phenyl]-, B-4706, 2-Difluoromethyl-phenylboronicacid, 2-Difluoromethyl-benzeneboronic acid, 2-DIFLUOROMETHYL-PHENYLBORONIC ACID PINACOL ESTER,

Complexity	143
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	172.051g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	171.938g/mol
Monoisotopic Mass	172.051g/mol
Rotatable Bond Count	2
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	\N
Hazard statements	H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P305+P351+P338
UN Code	\N

Certificate of Analysis

Lot Number