Home Nitriles 4-(4-oxopiperidin-1-yl)benzonitrile

4-(4-oxopiperidin-1-yl)benzonitrile

CAS No.:
79421-46-8
Catalog Number:
AG00G8L0
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00G8L0
Chemical Name:
4-(4-oxopiperidin-1-yl)benzonitrile
CAS Number:
79421-46-8
MDL Number:
MFCD11038443
IUPAC Name:
4-(4-oxopiperidin-1-yl)benzonitrile
InChI:
InChI=1S/C12H12N2O/c13-9-10-1-3-11(4-2-10)14-7-5-12(15)6-8-14/h1-4H,5-8H2
InChI Key:
RJWQDPGTDSRETR-UHFFFAOYSA-N
Properties
Complexity:
273  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.095g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.241g/mol
Monoisotopic Mass:
200.095g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties