AG001RJR

15996-78-8 | 2-Chloro-5-(trifluoroMethyl)benzylaMine

AG001RJR

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CAS Number	15996-78-8
Catalog Number	AG001RJR(AGN-PC-0KK7ZU)
Chemical Name	2-Chloro-5-(trifluoroMethyl)benzylaMine
IUPAC Name	[2-chloro-5-(trifluoromethyl)phenyl]methanamine
InChI	InChI=1S/C8H7ClF3N/c9-7-2-1-6(8(10,11)12)3-5(7)4-13/h1-3H,4,13H2
InChI Key	XOCMZYUQWVACMA-UHFFFAOYSA-N
MDL Number	MFCD00190123
Molecular Formula	C8H7ClF3N
Molecular Weight	209.5961
SMILES	NCC1=C(Cl)C=CC(C(F)(F)F)=C1
Synonyms	2-Chloro-5-(trifluoromethyl)benzylamine, 15996-78-8, [2-chloro-5-(trifluoromethyl)phenyl]methanamine, 2-chloro-5-trifluoromethyl-benzylamine, 2-chloro-5-(trifluoromethyl)benzyl amine, 2-Chloro-5-trifluoromethylbenzylamine, 2-chloro-5-trifluoromethylbenzyl amine, MFCD00190123, Benzenemethanamine, 2-chloro-5-(trifluoromethyl)-, (2-chloro-5-(trifluoromethyl)phenyl)methanamine, [2-chloro-5-(trifluoromethyl)phenyl]methylamine, PubChem4392, AC1MC64O, SCHEMBL856434, RARECHEM AL BW 0385, CTK4D0279, TIMTEC-BB SBB028422, DTXSID00371525, XOCMZYUQWVACMA-UHFFFAOYSA-N, ACT00650, JRD-0790, ZINC2556416, ANW-47487, SBB028422, AKOS015850171, AN-6294, AS00474, MCULE-1073457977, PS-8024, VZ24279, 2-chloro-5-trifluoromethyl benzyl amine, AC-25947, AJ-39890, BR-33512, U544, AB0019328, DB-008187, ST2404333, TR-006782, FT-0611809, ST50407444, 2-Chloro-5-(trifluoromethyl)benzylamine, 97%, A19823, S-2716, 2 - Chloro - 5 - (trifluoromethyl)benzylamine, Benzenemethanamine,2-chloro-5-(trifluoromethyl)-, J-009660, 3-(Aminomethyl)-4-chlorobenzotrifluoride, [2-Chloro-5-(trifluoromethyl)phenyl]methylamine, C8H7ClF3N, CID2736682, 2-Chloro-5-trifluoromethylbenzyl chloride,

Complexity	171
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	209.022g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	209.596g/mol
Monoisotopic Mass	209.022g/mol
Rotatable Bond Count	1
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	6.1
Hazard statements	H301-H315-H317-H319
Packing Group	Ⅲ
Precautionary statements	P280-P301+P310-P305+P351+P338
UN Code	UN 2810

Certificate of Analysis

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