Home Nitriles 2-Amino-4-nitrobenzonitrile

2-Amino-4-nitrobenzonitrile

CAS No.:
87376-25-8
Catalog Number:
AG004K78
Molecular Formula:
C7H5N3O2
Molecular Weight:
163.1335
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$37
- +
5g
97%
In Stock USA
United States
$107
- +
10g
97%
In Stock USA
United States
$175
- +
25g
97%
In Stock USA
United States
$350
- +
Product Description
Catalog Number:
AG004K78
Chemical Name:
2-Amino-4-nitrobenzonitrile
CAS Number:
87376-25-8
Molecular Formula:
C7H5N3O2
Molecular Weight:
163.1335
MDL Number:
MFCD04117876
IUPAC Name:
2-amino-4-nitrobenzonitrile
InChI:
InChI=1S/C7H5N3O2/c8-4-5-1-2-6(10(11)12)3-7(5)9/h1-3H,9H2
InChI Key:
WLKYODIBWNIWDK-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1N)[N+](=O)[O-]
Properties
Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.038g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
163.136g/mol
Monoisotopic Mass:
163.038g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
95.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties