Home Nitriles 3-oxo-3-(pyridin-4-yl)propanenitrile

3-oxo-3-(pyridin-4-yl)propanenitrile

CAS No.:
23821-37-6
Catalog Number:
AG007N1Q
Molecular Formula:
C8H6N2O
Molecular Weight:
146.1460
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
tech grade
In Stock USA
United States
$75
- +
1g
tech grade
In Stock USA
United States
$132
- +
5g
tech grade
In Stock USA
United States
$438
- +
10g
tech grade
In Stock USA
United States
$763
- +
25g
tech grade
In Stock USA
United States
$1500
- +
Product Description
Catalog Number:
AG007N1Q
Chemical Name:
3-oxo-3-(pyridin-4-yl)propanenitrile
CAS Number:
23821-37-6
Molecular Formula:
C8H6N2O
Molecular Weight:
146.1460
MDL Number:
MFCD06656807
IUPAC Name:
3-oxo-3-pyridin-4-ylpropanenitrile
InChI:
InChI=1S/C8H6N2O/c9-4-1-8(11)7-2-5-10-6-3-7/h2-3,5-6H,1H2
InChI Key:
PPBAZOANEQPCKG-UHFFFAOYSA-N
SMILES:
N#CCC(=O)c1ccncc1
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.048g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
146.149g/mol
Monoisotopic Mass:
146.048g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
53.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties