Home Nitriles 4-Bromo-2-(methylamino)benzonitrile

4-Bromo-2-(methylamino)benzonitrile

CAS No.:
954226-93-8
Catalog Number:
AG00IJ24
Molecular Formula:
C8H7BrN2
Molecular Weight:
211.0586
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00IJ24
Chemical Name:
4-Bromo-2-(methylamino)benzonitrile
CAS Number:
954226-93-8
Molecular Formula:
C8H7BrN2
Molecular Weight:
211.0586
MDL Number:
MFCD09862647
IUPAC Name:
4-bromo-2-(methylamino)benzonitrile
InChI:
InChI=1S/C8H7BrN2/c1-11-8-4-7(9)3-2-6(8)5-10/h2-4,11H,1H3
InChI Key:
CDRZTDLGHZNPEG-UHFFFAOYSA-N
SMILES:
CNc1cc(Br)ccc1C#N
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.979g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.062g/mol
Monoisotopic Mass:
209.979g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties