3-Isoquinolinamine, 1-bromo-


Chemical Name: 3-Isoquinolinamine, 1-bromo-
CAS Number: 13130-79-5
Product Number: AG000VWA(AGN-PC-0JPB1S)
Synonyms:
MDL No:
Molecular Formula: C9H7BrN2
Molecular Weight: 223.0693

Identification/Properties


Properties
MP:
144 °C
BP:
387.8°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Stability:
Air Sensitive
Computed Properties
Molecular Weight:
223.073g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
221.979g/mol
Monoisotopic Mass:
221.979g/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

Safety Information


NMR Spectrum


Other Analytical Data


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