8-bromo-4H-chromen-3-one


Chemical Name: 8-bromo-4H-chromen-3-one
CAS Number: 133118-80-6
Product Number: AG0014AD(AGN-PC-023JTX)
Synonyms:
MDL No:
Molecular Formula: C9H7BrO2
Molecular Weight: 227.0547

Identification/Properties


Computed Properties
Molecular Weight:
227.057g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
225.963g/mol
Monoisotopic Mass:
225.963g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
193
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


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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