AG007I8G

153505-36-3 | 4-Bromo-5-fluoro-2-nitroaniline

AG007I8G

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CAS Number	153505-36-3
Catalog Number	AG007I8G(AGN-PC-03HLMR)
Chemical Name	4-Bromo-5-fluoro-2-nitroaniline
IUPAC Name	4-bromo-5-fluoro-2-nitroaniline
InChI	InChI=1S/C6H4BrFN2O2/c7-3-1-6(10(11)12)5(9)2-4(3)8/h1-2H,9H2
InChI Key	UBANSCIKTQSEOQ-UHFFFAOYSA-N
MDL Number	MFCD11101433
Molecular Formula	C6H4BrFN2O2
Molecular Weight	235.0106
SMILES	NC1=C(C=C(Br)C(F)=C1)[N+]([O-])=O
Synonyms	4-Bromo-5-fluoro-2-nitroaniline, 153505-36-3, 4-bromo-5-fluoro-2-nitrophenylamine, Benzenamine,4-bromo-5-fluoro-2-nitro-, Benzenamine, 4-bromo-5-fluoro-2-nitro-, ACMC-209d9d, SCHEMBL240941, CTK4C7873, DTXSID00619974, 4-Bromo-3-fluoro-6-nitroaniline, UBANSCIKTQSEOQ-UHFFFAOYSA-N, ANW-21455, MFCD11101433, SBB098340, ZINC36533678, 2-Amino-5-bromo-4-fluoronitrobenzene, AKOS013152965, RP05669, RTR-006350, VZ28556, 4-bromanyl-5-fluoranyl-2-nitro-aniline, AJ-93236, AK-31994, CJ-18970, DS-11646, SY047808, TR-006350, FT-0750725, Y7619, MFCD11101433 (95%), B-3765, A809433, W-205745, I14-24775, 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	2.4

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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