4-iodoisoquinolin-1-amine


Chemical Name: 4-iodoisoquinolin-1-amine
CAS Number: 55270-28-5
Product Number: AG00DKUW(AGN-PC-0JU7KF)
Synonyms:
MDL No:
Molecular Formula: C9H7IN2
Molecular Weight: 270.0697

Identification/Properties


Computed Properties
Molecular Weight:
270.073g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
269.965g/mol
Monoisotopic Mass:
269.965g/mol
Topological Polar Surface Area:
38.9A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
163
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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