AG01DU6Y

2153472-94-5 | 2,2,2-Trifluoro-1-(Pyridin-4-Yl)Ethanamine Dihydrochloride

AG01DU6Y

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CAS Number	2153472-94-5
Catalog Number	AG01DU6Y
Chemical Name	2,2,2-Trifluoro-1-(Pyridin-4-Yl)Ethanamine Dihydrochloride
IUPAC Name	2,2,2-trifluoro-1-pyridin-4-ylethanamine;dihydrochloride
InChI	InChI=1S/C7H7F3N2.2ClH/c8-7(9,10)6(11)5-1-3-12-4-2-5;;/h1-4,6H,11H2;2*1H
InChI Key	GUOGYWOVINNATR-UHFFFAOYSA-N
MDL Number	MFCD31568143
Molecular Formula	C7H9Cl2F3N2
Molecular Weight	249.0610
SMILES	FC(F)(F)C(N)C1=CC=NC=C1.[H]Cl.[H]Cl
Synonyms	2,2,2-Trifluoro-1-(pyridin-4-yl)ethanamine dihydrochloride, 2153472-94-5, AK689411, DS-20228, 2,2,2-TRIFLUORO-1-(PYRIDIN-4-YL)ETHAN-1-AMINE 2HCL,

Complexity	140
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	248.009g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	249.058g/mol
Monoisotopic Mass	248.009g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	38.9A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0

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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