AG003KHS

870778-87-3 | 4,5-Difluoro-2-ethoxyphenylboronic acid

AG003KHS

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CAS Number	870778-87-3
Catalog Number	AG003KHS(AGN-PC-0VAHT0)
Chemical Name	4,5-Difluoro-2-ethoxyphenylboronic acid
IUPAC Name	(2-ethoxy-4,5-difluorophenyl)boronic acid
InChI	InChI=1S/C8H9BF2O3/c1-2-14-8-4-7(11)6(10)3-5(8)9(12)13/h3-4,12-13H,2H2,1H3
InChI Key	DIDGIGNOIJJEGJ-UHFFFAOYSA-N
MDL Number	MFCD07784347
Molecular Formula	C8H9BF2O3
Molecular Weight	201.9631
SMILES	FC1=C(F)C=C(OCC)C(B(O)O)=C1
Synonyms	870778-87-3, (2-Ethoxy-4,5-difluorophenyl)boronic acid, 4,5-Difluoro-2-ethoxyphenylboronic acid, ACMC-209qe0, CTK5F7741, DTXSID50584628, ANW-38470, MFCD07784347, AKOS015853456, ZINC169748150, FCH1323698, RTR-027128, 4,5-difluro-2-ethoxyphenylboronic acid, BC001838, PC412098, AX8218021, (2-Ethoxy-4,5-difluoro-phenyl)boronic acid, ST24033882, X1406, B-(2-Ethoxy-4,5-difluorophenyl)boronic acid, B-4318, Boronic acid,B-(2-ethoxy-4,5-difluorophenyl)-, I04-2842, J-519644, C8H9BF2O3,

Complexity	182
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	202.061g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	201.964g/mol
Monoisotopic Mass	202.061g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	49.7A^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

Lot Number