AG0036NS

96558-73-5 | 2-Bromo-3-chloroaniline

AG0036NS

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CAS Number	96558-73-5
Catalog Number	AG0036NS(AGN-PC-00HB5C)
Chemical Name	2-Bromo-3-chloroaniline
IUPAC Name	2-bromo-3-chloroaniline
InChI	InChI=1S/C6H5BrClN/c7-6-4(8)2-1-3-5(6)9/h1-3H,9H2
InChI Key	JHHMLFBYFNAPDZ-UHFFFAOYSA-N
MDL Number	MFCD10699543
Molecular Formula	C6H5BrClN
Molecular Weight	206.4676
SMILES	Brc1c(N)cccc1Cl
Synonyms	2-bromo-3-chloroaniline, 96558-73-5, 2-Bromo-3-chloro-phenylamine, JHHMLFBYFNAPDZ-UHFFFAOYSA-N, BENZENAMINE, 2-BROMO-3-CHLORO-, 2-BROMO-3-CHLOROBENZENAMINE, Aniline, 2-bromo-3-chloro, SCHEMBL1381767, CTK5H8785, DTXSID70474294, ANW-51818, MFCD10699543, ZINC36471562, AKOS015835148, CM10246, CS-W018623, GS-4447, MB08909, RP26265, KS-000000O8, AC-28535, AJ-93000, AK-47455, BR-47455, CJ-18929, SC-43967, SY025600, AB0027908, TR-038607, 4CH-002773, AM20050014, FT-0660829, ST24027805, W9814, MFCD10699543 (97%), A19779, S-5518, AS-813/43501517, J-508209, C6H5BrClN, 2-bromo-3-chloro-aniline, ACN-052114, CID11843442,

Complexity	99.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	204.929g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	206.467g/mol
Monoisotopic Mass	204.929g/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	6.1
Hazard statements	H302
Packing Group	Ⅲ
Precautionary statements	P301+P312+P330
UN Code	UN 2811

Certificate of Analysis

Lot Number