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1784285-89-7 | 4-Isoquinolinamine, 8-chloro-
CAS No: 1784285-89-7 Catalog No: AG00261A MDL No:
Product Description
Catalog Number:
AG00261A
Chemical Name:
4-Isoquinolinamine, 8-chloro-
CAS Number:
1784285-89-7
Molecular Formula:
C9H7ClN2
Molecular Weight:
178.6183
IUPAC Name:
8-chloroisoquinolin-4-amine
InChI:
InChI=1S/C9H7ClN2/c10-8-3-1-2-6-7(8)4-12-5-9(6)11/h1-5H,11H2
InChI Key:
XOYPXBDIHGQDKV-UHFFFAOYSA-N
SMILES:
Clc1cccc2c1cncc2N
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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