AG007QKM

214210-21-6 | 3-Cyano-4-fluorobenzeneboronic acid

AG007QKM

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CAS Number	214210-21-6
Catalog Number	AG007QKM(AGN-PC-0KKM5Q)
Chemical Name	3-Cyano-4-fluorobenzeneboronic acid
IUPAC Name	(3-cyano-4-fluorophenyl)boronic acid
InChI	InChI=1S/C7H5BFNO2/c9-7-2-1-6(8(11)12)3-5(7)4-10/h1-3,11-12H
InChI Key	OLKIYJDSLMKNLC-UHFFFAOYSA-N
MDL Number	MFCD03095130
Molecular Formula	C7H5BFNO2
Molecular Weight	164.9295
SMILES	C(#N)c1cc(B(O)O)ccc1F
Synonyms	214210-21-6, 3-cyano-4-fluorobenzeneboronic acid, 3-Cyano-4-fluorophenylboronic acid, (3-Cyano-4-fluorophenyl)boronic acid, (3-cyano-4-fluoro-phenyl)boronic Acid, 3-Cyano-4-fluorophneylboronic acid, 2-FLUORO-5-BORONOBENZONITRILE, MFCD03095130, Boronic acid, (3-cyano-4-fluorophenyl)-, 3-Cyano-4-fluorobenzeneboronicacid, PubChem1802, AC1MBX2R, ACMC-1CQ96, KSC494O9L, SCHEMBL247641, AC1Q714F, CTK3J4795, DTXSID40374095, OLKIYJDSLMKNLC-UHFFFAOYSA-N, BM281, CS-D1035, KS-00000J3O, 3-cyano-4-fluoro phenylboronic acid, 3-cyano-4-fluoro-phenylboronic acid, 3-Cyano-4-fluorophenyl boronic acid, ANW-24429, SBB063439, 3-Cyano-4-Fluorophenyl-Boronic Acid, AKOS005146512, ZINC169745056, AB13505, AC-6167, CC-1629, LS11007, RP22758, RTR-010043, TRA0050941, AK-34089, AN-10322, AS-15063, BC000869, BR-34089, N817, SC-52904, SY026624, AB0016063, DB-025188, TL8001777, TR-010043, 4CH-003110, A4615, AM20030348, Boronic acid, B-(3-cyano-4-fluorophenyl)-, FT-0084876, FT-0652787, ST24028501, MFCD03095130 (98%), 3-Cyano-4-fluorophenylboronic acid, AldrichCPR, C-1452, 210C216, I01-1683, J-512355, C7H5BFNO2, ACN-044080, CID2757964, C2676, 3-cyano-4-fluorophenylboronic acid, 95% - 1G 1g, 1810-72-6,

Complexity	203
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	165.04g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	164.93g/mol
Monoisotopic Mass	165.04g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	64.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code	\N

Certificate of Analysis

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