AG008DO7

877161-74-5 | 2-Bromo-1,5-difluoro-3-nitrobenzene

AG008DO7

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CAS Number	877161-74-5
Catalog Number	AG008DO7(AGN-PC-04Z0Z4)
Chemical Name	2-Bromo-1,5-difluoro-3-nitrobenzene
IUPAC Name	2-bromo-1,5-difluoro-3-nitrobenzene
InChI	InChI=1S/C6H2BrF2NO2/c7-6-4(9)1-3(8)2-5(6)10(11)12/h1-2H
InChI Key	FCYPTYIIKJMNJZ-UHFFFAOYSA-N
MDL Number	MFCD04112512
Molecular Formula	C6H2BrF2NO2
Molecular Weight	237.9864
SMILES	[O-][N+](=O)C1=CC(F)=CC(F)=C1Br
Synonyms	2-Bromo-1,5-difluoro-3-nitrobenzene, 877161-74-5, 2,4-difluoro-6-nitrobromobenzene, 2-BROMO-3,5-DIFLUORONITROBENZENE, 2-Bromo-3,5-difluoro-1-nitrobenzene, Benzene, 2-bromo-1,5-difluoro-3-nitro-, MFCD04112512, SCHEMBL5500140, CTK8C4434, DTXSID40648642, WT257, ZINC2526723, 3946AC, ANW-71927, AKOS016007511, AS05640, CM12071, AJ-37688, AK-61344, DS-14754, TC-160672, 4CH-002509, TL80074111, Q-9517, 2,4-Difluoro-6-nitrobromobenzene[2-Bromo-3,5-difluoronitrobenzene], C6H2BrF2NO2,

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
Hazard statements	H302-H315-H320-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

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