AG00CLOF

346433-97-4 | 2-Bromo-4-fluoro-5-nitroaniline

AG00CLOF

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CAS Number	346433-97-4
Catalog Number	AG00CLOF(AGN-PC-0WD0N8)
Chemical Name	2-Bromo-4-fluoro-5-nitroaniline
IUPAC Name	2-bromo-4-fluoro-5-nitroaniline
InChI	InChI=1S/C6H4BrFN2O2/c7-3-1-4(8)6(10(11)12)2-5(3)9/h1-2H,9H2
InChI Key	FBVOIJABNHHFIF-UHFFFAOYSA-N
MDL Number	MFCD19237158
Molecular Formula	C6H4BrFN2O2
Molecular Weight	235.0106
SMILES	NC1=CC([N+]([O-])=O)=C(F)C=C1Br
Synonyms	2-Bromo-4-fluoro-5-nitroaniline, 346433-97-4, SCHEMBL431211, ACMC-209i91, CTK8B1504, DTXSID40591664, FBVOIJABNHHFIF-UHFFFAOYSA-N, 2-Bromo-4-fluoro-5-nitrobenzenamine, ANW-27923, MFCD19237158, ZINC74934294, AKOS015908162, FCH1352177, PC49648, AS-39201, CJ-21727, AJ-121359, AX8229534, ST2404207, TC-116668, V5350, A-2859, I14-24686, C6H4BrFN2O2,

Complexity	187
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	233.944g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	235.012g/mol
Monoisotopic Mass	233.944g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	71.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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