AG008DGK

874289-42-6 | (2-Fluoro-5-(pyrrolidine-1-carbonyl)phenyl)boronic acid

AG008DGK

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CAS Number	874289-42-6
Catalog Number	AG008DGK(AGN-PC-0786HS)
Chemical Name	(2-Fluoro-5-(pyrrolidine-1-carbonyl)phenyl)boronic acid
IUPAC Name	[2-fluoro-5-(pyrrolidine-1-carbonyl)phenyl]boronic acid
InChI	InChI=1S/C11H13BFNO3/c13-10-4-3-8(7-9(10)12(16)17)11(15)14-5-1-2-6-14/h3-4,7,16-17H,1-2,5-6H2
InChI Key	LUWFRPUCEBPJIZ-UHFFFAOYSA-N
MDL Number	MFCD08436030
Molecular Formula	C11H13BFNO3
Molecular Weight	237.0352
SMILES	O=C(C1=CC=C(F)C(B(O)O)=C1)N2CCCC2
Synonyms	874289-42-6, 2-Fluoro-5-(pyrrolidine-1-carbonyl)phenylboronic acid, (2-Fluoro-5-(pyrrolidine-1-carbonyl)phenyl)boronic acid, 2-Fluoro-5-(pyrrolidin-1-ylcarbonyl)benzeneboronic acid, 2-fluoro-5-(pyrolidine-1-carbonyl)phenylboronic acid, [2-fluoro-5-(pyrrolidine-1-carbonyl)phenyl]boronic acid, BORONIC ACID, B-[2-FLUORO-5-(1-PYRROLIDINYLCARBONYL)PHENYL]-, ACMC-209qmk, AC1Q713H, 2-fluoro-5-(pyrrolidine-1-carbonyl)benzeneboronic acid, CTK3E6621, DTXSID80660202, ZX-AP006909, ANW-38778, MFCD08436030, PC3581, SBB098707, AKOS015853362, ZINC169743990, RTR-027436, VB10554, AN-26761, BC001517, CC-10633, AX8013151, DB-021089, TR-027436, FT-0645011, ST24026138, Z0946, B-4500, 289F426, C-14061, 2-Fluoro-5-(Pyrrolidine-1-Carbonyl)phenyl-Boronic Acid, (2-Fluoro-5-(pyrrolidine-1-carbonyl)-phenyl)boronic acid, {2-fluoro-5-[(pyrrolidin-1-yl)carbonyl]phenyl}boronic acid, 2-fluoro-5-(pyrrolidin-1-ylcarbonyl)benzeneboronicacid98%, 2-FLUORO-5-(1-PYRROLIDINYLCARBONYL)BENZENEBORONIC ACID, 2-fluoro-5-(1-pyrrolidinylcarbonyl)benzeneboronic acid, 98%, 2-fluoro-5-(pyrrolidin-1-ylcarbonyl)benzeneboronic acid 98%, B-[2-FLUORO-5-(1-PYRROLIDINYLCARBONYL)PHENYL]-BORONIC ACID, C11H13BFNO3, ACN-042777, (2-Fluoro-5-(pyrrolidine-1-carbonyl)phenyl)boronicacid,

Complexity	284
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	237.097g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	237.037g/mol
Monoisotopic Mass	237.097g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	60.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H301-H315-H319-H335
Packing Group
Precautionary statements	P261-P280a-P301+P310a-P305+P351+P338-P405-P501a
UN Code

Certificate of Analysis

Lot Number