Home Aminos 3-amino-1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-one hydrochloride

3-amino-1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-one hydrochloride

CAS No.:
2044712-54-9
Catalog Number:
AG01BVSH
Molecular Formula:
C11H12ClF3N2O
Molecular Weight:
280.6740
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Product Description
Catalog Number:
AG01BVSH
Chemical Name:
3-amino-1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-one hydrochloride
CAS Number:
2044712-54-9
Molecular Formula:
C11H12ClF3N2O
Molecular Weight:
280.6740
MDL Number:
MFCD30486603
IUPAC Name:
3-amino-1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-one;hydrochloride
InChI:
InChI=1S/C11H11F3N2O.ClH/c12-11(13,14)7-1-3-8(4-2-7)16-6-5-9(15)10(16)17;/h1-4,9H,5-6,15H2;1H
InChI Key:
UCCNPBCBOWYLJG-UHFFFAOYSA-N
SMILES:
NC1CCN(C1=O)c1ccc(cc1)C(F)(F)F.Cl
Properties
Complexity:
298  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.059g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
280.675g/mol
Monoisotopic Mass:
280.059g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties