Home Nitriles 5-Aminoisophthalonitrile

5-Aminoisophthalonitrile

CAS No.:
57369-97-8
Catalog Number:
AG00ELBE
Molecular Formula:
Molecular Weight:
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$628
- +
1g
95%
1 week
United States
$1512
- +
Product Description
Catalog Number:
AG00ELBE
Chemical Name:
5-Aminoisophthalonitrile
CAS Number:
57369-97-8
MDL Number:
MFCD19203535
IUPAC Name:
5-aminobenzene-1,3-dicarbonitrile
InChI:
InChI=1S/C8H5N3/c9-4-6-1-7(5-10)3-8(11)2-6/h1-3H,11H2
InChI Key:
UBFORUHJOUPFHX-UHFFFAOYSA-N
Properties
Complexity:
204  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.048g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
143.149g/mol
Monoisotopic Mass:
143.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Literature
Title Journal
Protolytic dissociation of cyanoanilines in the ground and excited state in water and methanol solutions. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20081115
Properties