Home Halogens 4-Amino-3-chloro-5-nitrobenzonitrile

4-Amino-3-chloro-5-nitrobenzonitrile

CAS No.:
1456531-72-8
Catalog Number:
AG00HXG4
Molecular Formula:
C7H4ClN3O2
Molecular Weight:
197.5786
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$138
- +
5g
97%
In Stock USA
United States
$500
- +
Product Description
Catalog Number:
AG00HXG4
Chemical Name:
4-Amino-3-chloro-5-nitrobenzonitrile
CAS Number:
1456531-72-8
Molecular Formula:
C7H4ClN3O2
Molecular Weight:
197.5786
MDL Number:
MFCD25953942
IUPAC Name:
4-amino-3-chloro-5-nitrobenzonitrile
InChI:
InChI=1S/C7H4ClN3O2/c8-5-1-4(3-9)2-6(7(5)10)11(12)13/h1-2H,10H2
InChI Key:
OKYSJENLFHYHHB-UHFFFAOYSA-N
SMILES:
N#Cc1cc(Cl)c(c(c1)[N+](=O)[O-])N
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.999g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
197.578g/mol
Monoisotopic Mass:
196.999g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
95.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties