8-bromo-1-chloroisoquinoline


Chemical Name: 8-bromo-1-chloroisoquinoline
CAS Number: 1233025-78-9
Product Number: AG000KAU(AGN-PC-09MP15)
Synonyms:
MDL No: MFCD13193666
Molecular Formula: C9H5BrClN
Molecular Weight: 242.4997

Identification/Properties


Computed Properties
Molecular Weight:
242.5g/mol
XLogP3:
3.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
240.929g/mol
Monoisotopic Mass:
240.929g/mol
Topological Polar Surface Area:
12.9A^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

Safety Information


NMR Spectrum


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