Home Aminos 1-(3-aminoazetidin-1-yl)-2,2,2-trifluoroethan-1-one hydrochloride

1-(3-aminoazetidin-1-yl)-2,2,2-trifluoroethan-1-one hydrochloride

CAS No.:
1864051-98-8
Catalog Number:
AG01AUFW
Molecular Formula:
C5H8ClF3N2O
Molecular Weight:
204.5780
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Product Description
Catalog Number:
AG01AUFW
Chemical Name:
1-(3-aminoazetidin-1-yl)-2,2,2-trifluoroethan-1-one hydrochloride
CAS Number:
1864051-98-8
Molecular Formula:
C5H8ClF3N2O
Molecular Weight:
204.5780
MDL Number:
MFCD29034875
IUPAC Name:
1-(3-aminoazetidin-1-yl)-2,2,2-trifluoroethanone;hydrochloride
InChI:
InChI=1S/C5H7F3N2O.ClH/c6-5(7,8)4(11)10-1-3(9)2-10;/h3H,1-2,9H2;1H
InChI Key:
ALBMCOQYJVFNKW-UHFFFAOYSA-N
SMILES:
NC1CN(C1)C(=O)C(F)(F)F.Cl
Properties
Complexity:
173  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.028g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
204.577g/mol
Monoisotopic Mass:
204.028g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties