AG003GR1

53848-17-2 | 2-Bromo-6-methylaniline

AG003GR1

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CAS Number	53848-17-2
Catalog Number	AG003GR1(AGN-PC-0KKKXC)
Chemical Name	2-Bromo-6-methylaniline
IUPAC Name	2-bromo-6-methylaniline
InChI	InChI=1S/C7H8BrN/c1-5-3-2-4-6(8)7(5)9/h2-4H,9H2,1H3
InChI Key	LDUCMSVRKKDATH-UHFFFAOYSA-N
MDL Number	MFCD04039885
Molecular Formula	C7H8BrN
Molecular Weight	186.0491
SMILES	BrC1=C(N)C(=CC=C1)C
Synonyms	2-Bromo-6-methylaniline, 53848-17-2, 2-amino-3-bromotoluene, 2-Bromo-6-methyl-phenylamine, Benzenamine, 2-bromo-6-methyl-, 2-BROMO-6-METHYLBENZENAMINE, Brom-amino-toluol, PubChem15573, ACMC-1AVM6, 2-bromo-6-methyl-aniline, AC1MBT50, KSC494A7H, SCHEMBL286359, 2-Bromo-6-methylaniline, 95%, CTK3J4073, DTXSID90373311, LDUCMSVRKKDATH-UHFFFAOYSA-N, ACT00115, KS-00000F8V, ZINC2526507, ANW-49747, CL8391, GEO-00491, MFCD04039885, AKOS005255054, ACN-040329, AS05299, CM11316, CS-W007424, GS-4112, MB03160, RP24598, TRA0077435, AC-28667, AJ-37613, AK-40941, AN-40746, BC004019, BR-40941, CJ-08883, SC-17082, AB0025362, AB1007857, DB-010919, RT-001844, 4CH-006714, AM20060661, BB 0258136, FT-0611513, ST24027864, W6813, S-1823, 848B172, I01-7489, W-200414, I14-48604, null, C7H8BrN, ZINC02526507, CID2756250, A11666,

Complexity	94.9
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	184.984g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	186.052g/mol
Monoisotopic Mass	184.984g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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