7-Isoquinolinol, 1-chloro-


Chemical Name: 7-Isoquinolinol, 1-chloro-
CAS Number: 168003-06-3
Product Number: AG007VOG(AGN-PC-07YK5A)
Synonyms:
MDL No:
Molecular Formula: C9H6ClNO
Molecular Weight: 179.6030

Identification/Properties


Computed Properties
Molecular Weight:
179.603g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
179.014g/mol
Monoisotopic Mass:
179.014g/mol
Topological Polar Surface Area:
33.1A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
165
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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