AG005YZZ

957060-82-1 | 2,3-Difluoro-5-nitrophenylboronic acid

AG005YZZ

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CAS Number	957060-82-1
Catalog Number	AG005YZZ(AGN-PC-0W5CBD)
Chemical Name	2,3-Difluoro-5-nitrophenylboronic acid
IUPAC Name	(2,3-difluoro-5-nitrophenyl)boronic acid
InChI	InChI=1S/C6H4BF2NO4/c8-5-2-3(10(13)14)1-4(6(5)9)7(11)12/h1-2,11-12H
InChI Key	AARSYRVYLRWEBG-UHFFFAOYSA-N
MDL Number	MFCD09027242
Molecular Formula	C6H4BF2NO4
Molecular Weight	202.9081
SMILES	O=[N+](C1=CC(F)=C(F)C(B(O)O)=C1)[O-]
Synonyms	957060-82-1, 2,3-Difluoro-5-nitrophenylboronic acid, (2,3-Difluoro-5-nitrophenyl)boronic acid, 2,3-Difluoro-5-nitrobenzeneboronic acid, ACMC-209s14, SCHEMBL15668612, CTK5H7996, DTXSID40660283, ZX-AP009092, ANW-40598, MFCD09027242, PC7127, SBB093028, AKOS015854241, ZINC169745388, CD-1882, FCH1327001, RTR-029884, BC001905, (2,3-Difluoro-5-nitro-phenyl)boronic acid, AB0043268, AX8209661, TR-029884, ST24026093, Z1173, B-4476, I04-2782, C6H4BF2NO4,

Complexity	224
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	203.02g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	202.908g/mol
Monoisotopic Mass	203.02g/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	H315-H319-H335
Packing Group
Precautionary statements	P261-P280a-P304+P340-P305+P351+P338-P405-P501a
UN Code

Certificate of Analysis

Lot Number