AG007ILG

328956-60-1 | 3-Fluoro-5-formylphenylboronic acid

AG007ILG

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CAS Number	328956-60-1
Catalog Number	AG007ILG(AGN-PC-0WA8N8)
Chemical Name	3-Fluoro-5-formylphenylboronic acid
IUPAC Name	(3-fluoro-5-formylphenyl)boronic acid
InChI	InChI=1S/C7H6BFO3/c9-7-2-5(4-10)1-6(3-7)8(11)12/h1-4,11-12H
InChI Key	LAQDUOXSWHKHBB-UHFFFAOYSA-N
MDL Number	MFCD11856017
Molecular Formula	C7H6BFO3
Molecular Weight	167.9301
SMILES	O=CC1=CC(F)=CC(B(O)O)=C1
Synonyms	328956-60-1, 3-FLUORO-5-FORMYLPHENYLBORONIC ACID, (3-Fluoro-5-formylphenyl)boronic acid, MFCD11856017, ACMC-209hx0, SCHEMBL1771343, AMBA00027, CTK4G9518, DTXSID80624248, LAQDUOXSWHKHBB-UHFFFAOYSA-N, 3-fluoro-5-formylbenzeneboronic acid, ANW-27490, AKOS015853082, ZINC169748200, AB64854, AM85394, FCH1146616, PC32759, (3-Fluoro-5-formyl-phenyl)boronic acid, AK-61764, AS-48241, BC001774, SC-26529, Boronic acid, (3-fluoro-5-formylphenyl)-, TR-036495, ST24034394, Z0518, Q-8793, I04-2852, 1-2 weeks, C7H6BFO3, N/A,

Complexity	165
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	168.039g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	167.93g/mol
Monoisotopic Mass	168.039g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	57.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338-P310
UN Code	UN 3261

Certificate of Analysis

Lot Number