Home Nitriles 2-Chloro-4-methoxybenzonitrile

2-Chloro-4-methoxybenzonitrile

CAS No.:
127666-99-3
Catalog Number:
AG000X9F
Molecular Formula:
C8H6ClNO
Molecular Weight:
167.5923
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$25
- +
5g
97%
In Stock USA
United States
$88
- +
10g
97%
In Stock USA
United States
$150
- +
25g
97%
In Stock USA
United States
$300
- +
100g
97%
In Stock USA
United States
$938
- +
Product Description
Catalog Number:
AG000X9F
Chemical Name:
2-Chloro-4-methoxybenzonitrile
CAS Number:
127666-99-3
Molecular Formula:
C8H6ClNO
Molecular Weight:
167.5923
MDL Number:
MFCD00156133
IUPAC Name:
2-chloro-4-methoxybenzonitrile
InChI:
InChI=1S/C8H6ClNO/c1-11-7-3-2-6(5-10)8(9)4-7/h2-4H,1H3
InChI Key:
YLKLNODUMSCTIV-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)Cl)C#N
Properties
Complexity:
174  
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:
1  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties