Home Halogens 1,3-Dichloroisoquinolin-5-aMine

1,3-Dichloroisoquinolin-5-aMine

CAS No.:
58142-96-4
Catalog Number:
AG00EKVF
Molecular Formula:
C9H6Cl2N2
Molecular Weight:
213.0633
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Product Description
Catalog Number:
AG00EKVF
Chemical Name:
1,3-Dichloroisoquinolin-5-aMine
CAS Number:
58142-96-4
Molecular Formula:
C9H6Cl2N2
Molecular Weight:
213.0633
MDL Number:
MFCD13193567
IUPAC Name:
1,3-dichloroisoquinolin-5-amine
InChI:
InChI=1S/C9H6Cl2N2/c10-8-4-6-5(9(11)13-8)2-1-3-7(6)12/h1-4H,12H2
InChI Key:
IQDDSRIIBRSGOG-UHFFFAOYSA-N
SMILES:
Clc1nc(Cl)c2c(c1)c(N)ccc2
Properties
Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.991g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
213.061g/mol
Monoisotopic Mass:
211.991g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties