Home Other Building Blocks 1-(2,2,2-trifluoroethyl)piperidin-3-one

1-(2,2,2-trifluoroethyl)piperidin-3-one

CAS No.:
1517389-96-6
Catalog Number:
AG01DVI0
Molecular Formula:
C7H10F3NO
Molecular Weight:
181.1556
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Product Description
Catalog Number:
AG01DVI0
Chemical Name:
1-(2,2,2-trifluoroethyl)piperidin-3-one
CAS Number:
1517389-96-6
Molecular Formula:
C7H10F3NO
Molecular Weight:
181.1556
MDL Number:
MFCD24151904
IUPAC Name:
1-(2,2,2-trifluoroethyl)piperidin-3-one
InChI:
InChI=1S/C7H10F3NO/c8-7(9,10)5-11-3-1-2-6(12)4-11/h1-5H2
InChI Key:
DXAKJSORNYOXSN-UHFFFAOYSA-N
SMILES:
O=C1CCCN(C1)CC(F)(F)F
Properties
Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.071g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.158g/mol
Monoisotopic Mass:
181.071g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties