Home Nitriles 3-(Piperidin-4-yl)benzonitrile

3-(Piperidin-4-yl)benzonitrile

CAS No.:
370864-72-5
Catalog Number:
AG00BYXP
Molecular Formula:
C12H14N2
Molecular Weight:
186.2530
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$225
- +
1g
98%
In Stock USA
United States
$563
- +
5g
98%
In Stock USA
United States
$1688
- +
Product Description
Catalog Number:
AG00BYXP
Chemical Name:
3-(Piperidin-4-yl)benzonitrile
CAS Number:
370864-72-5
Molecular Formula:
C12H14N2
Molecular Weight:
186.2530
MDL Number:
MFCD03839908
IUPAC Name:
3-piperidin-4-ylbenzonitrile
InChI:
InChI=1S/C12H14N2/c13-9-10-2-1-3-12(8-10)11-4-6-14-7-5-11/h1-3,8,11,14H,4-7H2
InChI Key:
CSINBIMKXOMGDE-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1)C1CCNCC1
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.116g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
186.258g/mol
Monoisotopic Mass:
186.116g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties