Home Halogens 3,4-Diamino-5-chlorobenzonitrile

3,4-Diamino-5-chlorobenzonitrile

CAS No.:
1820704-16-2
Catalog Number:
AG00I0WM
Molecular Formula:
C7H6ClN3
Molecular Weight:
167.5956
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$100
- +
5g
98%
In Stock USA
United States
$300
- +
10g
98%
In Stock USA
United States
$525
- +
25g
98%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG00I0WM
Chemical Name:
3,4-Diamino-5-chlorobenzonitrile
CAS Number:
1820704-16-2
Molecular Formula:
C7H6ClN3
Molecular Weight:
167.5956
MDL Number:
MFCD28096658
IUPAC Name:
3,4-diamino-5-chlorobenzonitrile
InChI:
InChI=1S/C7H6ClN3/c8-5-1-4(3-9)2-6(10)7(5)11/h1-2H,10-11H2
InChI Key:
KXIQUMQADFSKSR-UHFFFAOYSA-N
SMILES:
N#Cc1cc(N)c(c(c1)Cl)N
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.025g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
167.596g/mol
Monoisotopic Mass:
167.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
75.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties