Isoquinoline, 4-bromo-1-methoxy-


Chemical Name: Isoquinoline, 4-bromo-1-methoxy-
CAS Number: 746668-73-5
Product Number: AG008PEY(AGN-PC-04QX7J)
Synonyms:
MDL No:
Molecular Formula: C10H8BrNO
Molecular Weight: 238.0806

Identification/Properties


Computed Properties
Molecular Weight:
238.084g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
236.979g/mol
Monoisotopic Mass:
236.979g/mol
Topological Polar Surface Area:
22.1A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
176
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


Other Analytical Data


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