Home Halogens 1-[2-chloro-6-(trifluoromethyl)pyridin-3-yl]ethan-1-amine

1-[2-chloro-6-(trifluoromethyl)pyridin-3-yl]ethan-1-amine

CAS No.:
944904-54-5
Catalog Number:
AG01ALXG
Molecular Formula:
C8H8ClF3N2
Molecular Weight:
224.6107
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Product Description
Catalog Number:
AG01ALXG
Chemical Name:
1-[2-chloro-6-(trifluoromethyl)pyridin-3-yl]ethan-1-amine
CAS Number:
944904-54-5
Molecular Formula:
C8H8ClF3N2
Molecular Weight:
224.6107
MDL Number:
MFCD10696228
IUPAC Name:
1-[2-chloro-6-(trifluoromethyl)pyridin-3-yl]ethanamine
InChI:
InChI=1S/C8H8ClF3N2/c1-4(13)5-2-3-6(8(10,11)12)14-7(5)9/h2-4H,13H2,1H3
InChI Key:
VBOBDQRDNMGLBX-UHFFFAOYSA-N
SMILES:
CC(c1ccc(nc1Cl)C(F)(F)F)N
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.033g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
224.611g/mol
Monoisotopic Mass:
224.033g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties