1(2H)-Phthalazinone, 4-(4-bromophenyl)-


Chemical Name: 1(2H)-Phthalazinone, 4-(4-bromophenyl)-
CAS Number: 76462-38-9
Product Number: AG003K2J(AGN-PC-0JUYXF)
Synonyms:
MDL No:
Molecular Formula: C14H9BrN2O
Molecular Weight: 301.1381

Identification/Properties


Computed Properties
Molecular Weight:
301.143g/mol
XLogP3:
3.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
299.99g/mol
Monoisotopic Mass:
299.99g/mol
Topological Polar Surface Area:
41.5A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
361
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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