5-bromo-2-methylphenyl-ethanone


Chemical Name: 5-bromo-2-methylphenyl-ethanone
CAS Number: 90326-54-8
Product Number: AG0039PA(AGN-PC-0WAKYS)
Synonyms:
MDL No:
Molecular Formula: C9H9BrO
Molecular Weight: 213.0712

Identification/Properties


Computed Properties
Molecular Weight:
213.074g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
211.984g/mol
Monoisotopic Mass:
211.984g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
156
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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