Home Nitriles 3-Pyridylacetonitrile

3-Pyridylacetonitrile

CAS No.:
6443-85-2
Catalog Number:
AG003F4F
Molecular Formula:
C7H6N2
Molecular Weight:
118.1359
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$19
- +
5g
97%
In Stock USA
United States
$57
- +
10g
97%
In Stock USA
United States
$100
- +
25g
97%
In Stock USA
United States
$200
- +
100g
97%
In Stock USA
United States
$525
- +
Product Description
Catalog Number:
AG003F4F
Chemical Name:
3-Pyridylacetonitrile
CAS Number:
6443-85-2
Molecular Formula:
C7H6N2
Molecular Weight:
118.1359
MDL Number:
MFCD00006406
IUPAC Name:
2-pyridin-3-ylacetonitrile
InChI:
InChI=1S/C7H6N2/c8-4-3-7-2-1-5-9-6-7/h1-2,5-6H,3H2
InChI Key:
OIPHWUPMXHQWLR-UHFFFAOYSA-N
SMILES:
N#CCc1cccnc1
EC Number:
229-241-1
NSC Number:
83226
Properties
Complexity:
122  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
118.053g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
118.139g/mol
Monoisotopic Mass:
118.053g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Literature
Title Journal
catena-Poly[[(3-methyl-pyridine)-copper(I)]-μ-cyanido-copper(I)-μ-cyanido]. Acta crystallographica. Section E, Structure reports online 20110801
Properties