Home Other Building Blocks 3-(trifluoromethyl)piperidin-2-one

3-(trifluoromethyl)piperidin-2-one

CAS No.:
1000934-03-1
Catalog Number:
AG019ME8
Molecular Formula:
C6H8F3NO
Molecular Weight:
167.1290
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Product Description
Catalog Number:
AG019ME8
Chemical Name:
3-(trifluoromethyl)piperidin-2-one
CAS Number:
1000934-03-1
Molecular Formula:
C6H8F3NO
Molecular Weight:
167.1290
MDL Number:
MFCD09802218
IUPAC Name:
3-(trifluoromethyl)piperidin-2-one
InChI:
InChI=1S/C6H8F3NO/c7-6(8,9)4-2-1-3-10-5(4)11/h4H,1-3H2,(H,10,11)
InChI Key:
WDEBTTOBFKEZBC-UHFFFAOYSA-N
SMILES:
FC(C1CCCNC1=O)(F)F
Properties
Complexity:
166  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.056g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
167.131g/mol
Monoisotopic Mass:
167.056g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties