Home Other Building Blocks 3-BROMO-1-(3,4-DIFLUOROPHENYL)PIPERIDIN-2-ONE

3-BROMO-1-(3,4-DIFLUOROPHENYL)PIPERIDIN-2-ONE

CAS No.:
1339755-76-8
Catalog Number:
AG01ELUP
Molecular Formula:
C11H10BrF2NO
Molecular Weight:
290.1040
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Product Description
Catalog Number:
AG01ELUP
Chemical Name:
3-BROMO-1-(3,4-DIFLUOROPHENYL)PIPERIDIN-2-ONE
CAS Number:
1339755-76-8
Molecular Formula:
C11H10BrF2NO
Molecular Weight:
290.1040
MDL Number:
MFCD19678840
IUPAC Name:
3-bromo-1-(3,4-difluorophenyl)piperidin-2-one
InChI:
InChI=1S/C11H10BrF2NO/c12-8-2-1-5-15(11(8)16)7-3-4-9(13)10(14)6-7/h3-4,6,8H,1-2,5H2
InChI Key:
XVSCTBQBDDZROG-UHFFFAOYSA-N
SMILES:
O=C1C(Br)CCCN1c1ccc(c(c1)F)F
Properties
Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.991g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.108g/mol
Monoisotopic Mass:
288.991g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties