AG004MLI

848779-87-3 | (2-(Benzyloxy)-4-fluorophenyl)boronic acid

AG004MLI

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CAS Number	848779-87-3
Catalog Number	AG004MLI(AGN-PC-0KL1T6)
Chemical Name	(2-(Benzyloxy)-4-fluorophenyl)boronic acid
IUPAC Name	(4-fluoro-2-phenylmethoxyphenyl)boronic acid
InChI	InChI=1S/C13H12BFO3/c15-11-6-7-12(14(16)17)13(8-11)18-9-10-4-2-1-3-5-10/h1-8,16-17H,9H2
InChI Key	IFPQNCKVOQKEIU-UHFFFAOYSA-N
MDL Number	MFCD03788402
Molecular Formula	C13H12BFO3
Molecular Weight	246.0420
SMILES	OB(O)C1=C(OCC2=CC=CC=C2)C=C(F)C=C1
Synonyms	2-Benzyloxy-4-fluorophenylboronic acid, 848779-87-3, (2-(Benzyloxy)-4-fluorophenyl)boronic acid, 2-Benzyloxy-4-fluorobenzeneboronic Acid, [2-(benzyloxy)-4-fluorophenyl]boronic acid, MFCD03788402, 2-(benzyloxy)-4-fluorophenylboronic acid, (2-benzyloxy-4-fluorophenyl)boronic acid, (4-fluoro-2-phenylmethoxyphenyl)boronic acid, Boronic acid, [4-fluoro-2-(phenylmethoxy)phenyl]-, Boronic acid,B-[4-fluoro-2-(phenylmethoxy)phenyl]-, PubChem5321, akos brn-0217, ACMC-209px6, AC1MD2T4, SCHEMBL1954543, CTK5F3337, DTXSID00382196, IFPQNCKVOQKEIU-UHFFFAOYSA-N, EBD36404, KS-000016LS, ANW-37864, SBB065869, AKOS004116598, ZINC169745007, AB15957, B1545G1, CB-1043, PS-9621, RL05220, RP07635, RTC-068085, TRA0042777, VB10019, 2-benzyloxyl-4-fluorophenylboronic acid, BC000970, 2-(Benzyloxy)-4-fluorobenzeneboronic acid, AB0020823, AB1004722, DB-010347, TC-068085, TL8005540, B3779, FT-0644905, ST24026114, V1843, B-5066, (4-fluoranyl-2-phenylmethoxy-phenyl)boronic acid, 779B873, A840967, I04-0638, J-508121, 2-Benzyloxy-4-fluorophenylboronicAcid(containsvaryingamountsofAnhydride), 2-benzyloxy-4-fluorophenylboronic acid (contains varying amounts of anhydride), C13H12BFO3, ACN-034219, CID2782665, 2-BENZYLOXY-4-FLUOROPHENYLBORONICACID, (4-fluoro-2-phenylmethoxy-phenyl)boronic Acid,

Complexity	246
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	246.086g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	246.044g/mol
Monoisotopic Mass	246.086g/mol
Rotatable Bond Count	4
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
Packing Group
Precautionary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
UN Code

Certificate of Analysis

Lot Number