AG00CAYR

374633-24-6 | 1-Bromo-2,3-difluoro-5-nitrobenzene

AG00CAYR

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CAS Number	374633-24-6
Catalog Number	AG00CAYR(AGN-PC-05W1V1)
Chemical Name	1-Bromo-2,3-difluoro-5-nitrobenzene
IUPAC Name	1-bromo-2,3-difluoro-5-nitrobenzene
InChI	InChI=1S/C6H2BrF2NO2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H
InChI Key	MGMBTDXCNDOKOP-UHFFFAOYSA-N
MDL Number	MFCD03095339
Molecular Formula	C6H2BrF2NO2
Molecular Weight	237.9864
SMILES	O=[N+](C1=CC(F)=C(F)C(Br)=C1)[O-]
Synonyms	1-bromo-2,3-difluoro-5-nitrobenzene, 374633-24-6, 3-Bromo-4,5-difluoronitrobenzene, MFCD03095339, SCHEMBL2383502, DTXSID40654066, 1-Bromo-2,3-difluoronitrobenzene, ZINC2384137, AKOS024261691, AS05641, CM12072, NE60000, AJ-35069, AS-33069, Benzene, 1-bromo-2,3-difluoro-5-nitro-, EN300-91854, 1-bromanyl-2,3-bis(fluoranyl)-5-nitro-benzene, A824839, 399-94-0,

Complexity	187
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	236.924g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	237.988g/mol
Monoisotopic Mass	236.924g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	45.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301-H311-H330-H334-H335
Packing Group	Ⅱ
Precautionary statements	P280
UN Code	UN 2810

Certificate of Analysis

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