Home Nitriles 3-Chlorophenoxyacetonitrile

3-Chlorophenoxyacetonitrile

CAS No.:
43111-32-6
Catalog Number:
AG003JB5
Molecular Formula:
C8H6ClNO
Molecular Weight:
167.5923
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$25
- +
5g
98%
In Stock USA
United States
$63
- +
25g
98%
In Stock USA
United States
$188
- +
100g
98%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG003JB5
Chemical Name:
3-Chlorophenoxyacetonitrile
CAS Number:
43111-32-6
Molecular Formula:
C8H6ClNO
Molecular Weight:
167.5923
MDL Number:
MFCD00017332
IUPAC Name:
2-(3-chlorophenoxy)acetonitrile
InChI:
InChI=1S/C8H6ClNO/c9-7-2-1-3-8(6-7)11-5-4-10/h1-3,6H,5H2
InChI Key:
NHHNUPMHGVIQQC-UHFFFAOYSA-N
SMILES:
N#CCOc1cccc(c1)Cl
Properties
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.014g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.592g/mol
Monoisotopic Mass:
167.014g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties