Home Nitriles 4-(Piperidinocarbonyl)benzonitrile

4-(Piperidinocarbonyl)benzonitrile

CAS No.:
160094-26-8
Catalog Number:
AG001RNN
Molecular Formula:
C13H14N2O
Molecular Weight:
214.2631
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$169
- +
5g
97%
In Stock USA
United States
$675
- +
Product Description
Catalog Number:
AG001RNN
Chemical Name:
4-(Piperidinocarbonyl)benzonitrile
CAS Number:
160094-26-8
Molecular Formula:
C13H14N2O
Molecular Weight:
214.2631
MDL Number:
MFCD06867205
IUPAC Name:
4-(piperidine-1-carbonyl)benzonitrile
InChI:
InChI=1S/C13H14N2O/c14-10-11-4-6-12(7-5-11)13(16)15-8-2-1-3-9-15/h4-7H,1-3,8-9H2
InChI Key:
GOQGGRLSEMFETA-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)C(=O)N1CCCCC1
Properties
Complexity:
290  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.111g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.268g/mol
Monoisotopic Mass:
214.111g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties