Home Other Building Blocks 1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethan-1-amine dihydrochloride

1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethan-1-amine dihydrochloride

CAS No.:
1803590-17-1
Catalog Number:
AG01AFND
Molecular Formula:
C9H19Cl2F3N2
Molecular Weight:
283.1618
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Product Description
Catalog Number:
AG01AFND
Chemical Name:
1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethan-1-amine dihydrochloride
CAS Number:
1803590-17-1
Molecular Formula:
C9H19Cl2F3N2
Molecular Weight:
283.1618
MDL Number:
MFCD27500930
IUPAC Name:
1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethanamine;dihydrochloride
InChI:
InChI=1S/C9H17F3N2.2ClH/c1-7(13)8-2-4-14(5-3-8)6-9(10,11)12;;/h7-8H,2-6,13H2,1H3;2*1H
InChI Key:
KGNVXMFTVAYCKL-UHFFFAOYSA-N
SMILES:
CC(C1CCN(CC1)CC(F)(F)F)N.Cl.Cl
Properties
Complexity:
173  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.088g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
283.16g/mol
Monoisotopic Mass:
282.088g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties