AG00EBO8

64085-52-5 | 5-Bromo-2-iodoaniline

AG00EBO8

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CAS Number	64085-52-5
Catalog Number	AG00EBO8(AGN-PC-00O25P)
Chemical Name	5-Bromo-2-iodoaniline
IUPAC Name	5-bromo-2-iodoaniline
InChI	InChI=1S/C6H5BrIN/c7-4-1-2-5(8)6(9)3-4/h1-3H,9H2
InChI Key	KISIGYZVSJKAEK-UHFFFAOYSA-N
MDL Number	MFCD09753734
Molecular Formula	C6H5BrIN
Molecular Weight	297.9191
SMILES	NC1=CC(Br)=CC=C1I
Synonyms	5-bromo-2-iodoaniline, 64085-52-5, BENZENAMINE, 5-BROMO-2-IODO-, 5-BROMO-2-IODOBENZENAMINE, 5-Bromo-2-iodo-phenylamine, PubChem5332, 2-Iodo-5-bromoaniline, 5-bromo-2-iodo-aniline, 5-Bromo-2-iodophenylamine, ACMC-1B9X9, 5-bromanyl-2-iodanyl-aniline, KSC493O7N, AC1Q512N, SCHEMBL1574809, CTK3J3776, DTXSID60549965, KISIGYZVSJKAEK-UHFFFAOYSA-N, ANW-34804, CL8447, KM0816, MFCD09753734, ZINC28278305, AKOS008128733, AB51497, AS03352, CS-W004813, MCULE-6718828756, RTR-037376, WT82019, AC-28491, AJ-83404, AK-55133, AN-38864, BC002944, CJ-17664, DS-14690, SC-43688, SY029040, AB0051563, DB-073439, TR-037376, 4CH-000280, FT-0686976, ST24023921, V7071, EN300-52497, MFCD09753734 (98%), AB01004768-01, 085B525, A834636, I14-24755, C6H5BrIN, ACN-054221,

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

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