AG0038SN

352530-22-4 | 4-Fluoro-3-nitrophenylboronic acid

AG0038SN

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CAS Number	352530-22-4
Catalog Number	AG0038SN(AGN-PC-04TKQU)
Chemical Name	4-Fluoro-3-nitrophenylboronic acid
IUPAC Name	(4-fluoro-3-nitrophenyl)boronic acid
InChI	InChI=1S/C6H5BFNO4/c8-5-2-1-4(7(10)11)3-6(5)9(12)13/h1-3,10-11H
InChI Key	JDPKQZFQCPEJNH-UHFFFAOYSA-N
MDL Number	MFCD08277236
Molecular Formula	C6H5BFNO4
Molecular Weight	184.9176
SMILES	FC1=C(C=C(C=C1)B(O)O)[N+](=O)[O-]
Synonyms	4-FLUORO-3-NITROPHENYLBORONIC ACID, 352530-22-4, (4-fluoro-3-nitrophenyl)boronic acid, (4-fluoro-3-nitro-phenyl)boronic acid, 5-Borono-2-fluoronitrobenzene, AK-25833, 3-NITRO-4-FLUOROPHENYLBORONIC ACID, 4-FLUORO-3-NITROBENZENEBORONIC ACID, 4-Fluoro-3-nitrophenylboronicacid, PubChem1855, ACMC-1AIFE, SCHEMBL1442991, CTK4H4059, DTXSID20647875, ABLOCK AB-10-8650, JDPKQZFQCPEJNH-UHFFFAOYSA-N, KS-00000NF1, ZX-AP011430, ANW-28134, CF-053, FCH921582, MFCD08277236, PC9161, SBB065906, AKOS006344984, ZINC169747413, AB44870, AS06743, RP24503, RTR-014580, VB10310, ACM352530224, AN-28709, BC000792, BR-25833, CC-19239, DS-10579, AB0076317, AX8008295, Boronic acid,B-(4-fluoro-3-nitrophenyl)-, DB-028890, ST2405794, TR-014580, A6190, FT-0630271, A-1895, 530F224, C-24419, I04-0787, J-515383, C6H5BFNO4,

Complexity	198
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	185.03g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	184.917g/mol
Monoisotopic Mass	185.03g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	86.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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