Home Halogens 2,3-DiaMino-6-chlorobenzonitrile

2,3-DiaMino-6-chlorobenzonitrile

CAS No.:
548457-80-3
Catalog Number:
AG00DLF3
Molecular Formula:
C7H6ClN3
Molecular Weight:
167.5956
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Product Description
Catalog Number:
AG00DLF3
Chemical Name:
2,3-DiaMino-6-chlorobenzonitrile
CAS Number:
548457-80-3
Molecular Formula:
C7H6ClN3
Molecular Weight:
167.5956
MDL Number:
MFCD20723943
IUPAC Name:
2,3-diamino-6-chlorobenzonitrile
InChI:
InChI=1S/C7H6ClN3/c8-5-1-2-6(10)7(11)4(5)3-9/h1-2H,10-11H2
InChI Key:
FJSOJNZXBJCWNZ-UHFFFAOYSA-N
SMILES:
N#Cc1c(Cl)ccc(c1N)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:
1.5  
Properties