Benzeneacetic acid, 4-(bromomethyl)-, 2-oxo-2-phenylethyl ester


Chemical Name: Benzeneacetic acid, 4-(bromomethyl)-, 2-oxo-2-phenylethyl ester
CAS Number: 66270-97-1
Product Number: AG003TNQ(AGN-PC-0JT2NT)
Synonyms:
MDL No:
Molecular Formula: C17H15BrO3
Molecular Weight: 347.2032

Identification/Properties


Properties
MP:
84-87℃ (lit.)
BP:
457.8°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
347.208g/mol
XLogP3:
3.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
7
Exact Mass:
346.02g/mol
Monoisotopic Mass:
346.02g/mol
Topological Polar Surface Area:
43.4A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
342
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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