AG0037KJ

58534-95-5 | 3-bromo-2-fluoroaniline

AG0037KJ

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CAS Number	58534-95-5
Catalog Number	AG0037KJ(AGN-PC-03OBD9)
Chemical Name	3-bromo-2-fluoroaniline
IUPAC Name	3-bromo-2-fluoroaniline
InChI	InChI=1S/C6H5BrFN/c7-4-2-1-3-5(9)6(4)8/h1-3H,9H2
InChI Key	HYPQOSVTIONWSN-UHFFFAOYSA-N
MDL Number	MFCD09864700
Molecular Formula	C6H5BrFN
Molecular Weight	190.0130
SMILES	BrC=1C(=C(N)C=CC1)F
Synonyms	3-Bromo-2-fluoroaniline, 58534-95-5, 3-bromo-2-fluorobenzenamine, 3-bromo-2-fluorophenylamine, Benzenamine, 3-bromo-2-fluoro-, 3-Brome-2-fluoroaniline, HYPQOSVTIONWSN-UHFFFAOYSA-N, MFCD09864700, 1-AMINO-3-BROMO-2-FLUOROBENZENE, KSC249I9L, 3-Bromo-2-fluoro-phenylamine, SCHEMBL123021, ACMC-209m56, CTK1E9495, KS-00000HPB, DTXSID90625004, WT087, ANW-32968, CL8412, SBB091035, ZINC16159705, AKOS006345737, AS05295, CM11302, CS-W004725, LS10570, PS-8403, RTR-037173, 58534-95-5 3-bromo-2-fluoroaniline, AC-28511, AJ-68742, AK-35755, BC005201, BR-35755, CJ-15478, SC-87318, SY011957, AB0025664, DB-023552, TR-037173, 4CH-000863, AM20040785, FT-0686968, ST24028426, W7161, MFCD09864700 (98%), B-8219, C6H5BrFN, 3-Bromo-2-fluoro Aniline, ACN-046819, 3-Bromo-2-fluoroaniline, 97% - 1G 1g,

Complexity	99.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	188.959g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	190.015g/mol
Monoisotopic Mass	188.959g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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