Home Nitriles 5-Chloro-2-methylbenzonitrile

5-Chloro-2-methylbenzonitrile

CAS No.:
50712-70-4
Catalog Number:
AG003MNH
Molecular Formula:
C8H6ClN
Molecular Weight:
151.5929
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$25
- +
5g
98%
In Stock USA
United States
$57
- +
25g
98%
In Stock USA
United States
$200
- +
100g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG003MNH
Chemical Name:
5-Chloro-2-methylbenzonitrile
CAS Number:
50712-70-4
Molecular Formula:
C8H6ClN
Molecular Weight:
151.5929
MDL Number:
MFCD00000257
IUPAC Name:
5-chloro-2-methylbenzonitrile
InChI:
InChI=1S/C8H6ClN/c1-6-2-3-8(9)4-7(6)5-10/h2-4H,1H3
InChI Key:
HFBZPKYQUFLCEL-UHFFFAOYSA-N
SMILES:
N#Cc1cc(Cl)ccc1C
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.019g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
151.593g/mol
Monoisotopic Mass:
151.019g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties