Home Other Building Blocks 5-benzylpiperidin-2-one

5-benzylpiperidin-2-one

CAS No.:
906624-61-1
Catalog Number:
AG01AN91
Molecular Formula:
C12H15NO
Molecular Weight:
189.2536
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Product Description
Catalog Number:
AG01AN91
Chemical Name:
5-benzylpiperidin-2-one
CAS Number:
906624-61-1
Molecular Formula:
C12H15NO
Molecular Weight:
189.2536
MDL Number:
MFCD24616291
IUPAC Name:
5-benzylpiperidin-2-one
InChI:
InChI=1S/C12H15NO/c14-12-7-6-11(9-13-12)8-10-4-2-1-3-5-10/h1-5,11H,6-9H2,(H,13,14)
InChI Key:
XKHPKADKGCQGIS-UHFFFAOYSA-N
SMILES:
O=C1CCC(CN1)Cc1ccccc1
NSC Number:
612077
Properties
Complexity:
197  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.115g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.258g/mol
Monoisotopic Mass:
189.115g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties