AG004LRH

860435-38-7 | 3-Bromo-4-iodoaniline

AG004LRH

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CAS Number	860435-38-7
Catalog Number	AG004LRH(AGN-PC-02V8AO)
Chemical Name	3-Bromo-4-iodoaniline
IUPAC Name	3-bromo-4-iodoaniline
InChI	InChI=1S/C6H5BrIN/c7-5-3-4(9)1-2-6(5)8/h1-3H,9H2
InChI Key	HBCBLDVYTZWYLL-UHFFFAOYSA-N
MDL Number	MFCD09753717
Molecular Formula	C6H5BrIN
Molecular Weight	297.9191
SMILES	NC1=CC=C(I)C(Br)=C1
Synonyms	3-bromo-4-iodoaniline, 860435-38-7, PubChem5323, ACMC-209q8b, AC1Q51KI, (3-bromo-4-iodophenyl)amine, 3-bromanyl-4-iodanyl-aniline, SCHEMBL17494942, CTK5F6214, DTXSID10608536, ANW-38265, MFCD09753717, ZINC28278302, AKOS015834604, AS03350, BENZENAMINE, 3-BROMO-4-IODO-, AC-28563, AJ-83403, AS-18064, BC002941, CJ-17663, DB-076543, TR-038031, CS-0088152, FT-0769197, V8152, EN300-66173, B-4814, A841536, I14-24640, C6H5BrIN, ACN-042394,

Complexity	99.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	296.865g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	297.921g/mol
Monoisotopic Mass	296.865g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	26A^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-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number