ethyl 3-(3-bromophenyl)-3-oxopropanoate


Chemical Name: ethyl 3-(3-bromophenyl)-3-oxopropanoate
CAS Number: 21575-91-7
Product Number: AG0070ME(AGN-PC-0JNFDK)
Synonyms:
MDL No: MFCD03424812
Molecular Formula: C11H11BrO3
Molecular Weight: 271.1072

Identification/Properties


Computed Properties
Molecular Weight:
271.11g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
5
Exact Mass:
269.989g/mol
Monoisotopic Mass:
269.989g/mol
Topological Polar Surface Area:
43.4A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
240
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:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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