Home Halogens 8-chloroisoquinolin-5-amine

8-chloroisoquinolin-5-amine

CAS No.:
934554-41-3
Catalog Number:
AG00H14E
Molecular Formula:
C9H7ClN2
Molecular Weight:
178.6183
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Product Description
Catalog Number:
AG00H14E
Chemical Name:
8-chloroisoquinolin-5-amine
CAS Number:
934554-41-3
Molecular Formula:
C9H7ClN2
Molecular Weight:
178.6183
MDL Number:
MFCD17169868
IUPAC Name:
8-chloroisoquinolin-5-amine
InChI:
InChI=1S/C9H7ClN2/c10-8-1-2-9(11)6-3-4-12-5-7(6)8/h1-5H,11H2
InChI Key:
KPTATDQIEWLVTK-UHFFFAOYSA-N
SMILES:
Nc1ccc(c2c1ccnc2)Cl
Properties
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.03g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
178.619g/mol
Monoisotopic Mass:
178.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties