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1824065-49-7 | 8-Isoquinolinamine, 4-chloro-
CAS No: 1824065-49-7 Catalog No: AG0023TY MDL No:
Product Description
Catalog Number:
AG0023TY
Chemical Name:
8-Isoquinolinamine, 4-chloro-
CAS Number:
1824065-49-7
Molecular Formula:
C9H7ClN2
Molecular Weight:
178.6183
IUPAC Name:
4-chloroisoquinolin-8-amine
InChI:
InChI=1S/C9H7ClN2/c10-8-5-12-4-7-6(8)2-1-3-9(7)11/h1-5H,11H2
InChI Key:
ZJAJNJABBFHLAQ-UHFFFAOYSA-N
SMILES:
Nc1cccc2c1cncc2Cl
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
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