AG000RTJ

1261499-71-1 | Benzenamine, 2-chloro-3-(difluoromethyl)-

AG000RTJ

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CAS Number	1261499-71-1
Catalog Number	AG000RTJ(AGN-PC-03CI38)
Chemical Name	Benzenamine, 2-chloro-3-(difluoromethyl)-
IUPAC Name	2-chloro-3-(difluoromethyl)aniline
InChI	InChI=1S/C7H6ClF2N/c8-6-4(7(9)10)2-1-3-5(6)11/h1-3,7H,11H2
InChI Key	JSAZZDKKLYHTRZ-UHFFFAOYSA-N
MDL Number	MFCD18392773
Molecular Formula	C7H6ClF2N
Molecular Weight	177.5790
SMILES	C1=CC(=C(C(=C1)N)Cl)C(F)F
Synonyms	2-chloro-3-(difluoromethyl)aniline, 1261499-71-1, SCHEMBL11800950, CTK8E3877, JSAZZDKKLYHTRZ-UHFFFAOYSA-N, KS-000009ZE, MFCD18392773, ZINC83428681, AKOS024058195, NE35020, TRA0076277, CS-11887, SY032616, Benzenamine, 2-chloro-3-(difluoromethyl)-, TX-016348, FT-0732002, MFCD18392773 (95%), 2-chloro-3-(difluoromethyl)Benzenamine,

Complexity	132
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	177.016g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	177.579g/mol
Monoisotopic Mass	177.016g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

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