AG000D6E

116759-33-2 | Benzenamine, 4-chloro-2-fluoro-5-methyl-

AG000D6E

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CAS Number	116759-33-2
Catalog Number	AG000D6E(AGN-PC-000I6P)
Chemical Name	Benzenamine, 4-chloro-2-fluoro-5-methyl-
IUPAC Name	4-chloro-2-fluoro-5-methylaniline
InChI	InChI=1S/C7H7ClFN/c1-4-2-7(10)6(9)3-5(4)8/h2-3H,10H2,1H3
InChI Key	KENAMMSVUHVEOL-UHFFFAOYSA-N
MDL Number	MFCD09062485
Molecular Formula	C7H7ClFN
Molecular Weight	159.5886
SMILES	NC1=CC(C)=C(Cl)C=C1F
Synonyms	4-chloro-2-fluoro-5-methylaniline, 116759-33-2, PubChem2966, SCHEMBL5390700, KENAMMSVUHVEOL-UHFFFAOYSA-N, 2-Fluoro-4-chloro-5-methylaniline, 4-chloro-2-fluoro-5-methyl-aniline, FCH865468, MFCD09062485, ZINC34239132, AKOS006330414, AS05326, CM11369, LS10381, AJ-87583, AK160934, AN-33163, AS-33016, CJ-18255, EN001907, Benzenamine, 4-chloro-2-fluoro-5-methyl-, AX8072919, DB-060923, FT-0611754, ST24043552, 759C332, I14-37576, 2-chloro-4-fluoro-5-methylaniline, 2-chloro-4-fluoro-5-methyl aniline,

Complexity	120
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	159.025g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	159.588g/mol
Monoisotopic Mass	159.025g/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	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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