tert-butyl 4-[3-(4-bromophenyl)-3-oxopropanoyl]piperidine-1-carboxylate


Chemical Name: tert-butyl 4-[3-(4-bromophenyl)-3-oxopropanoyl]piperidine-1-carboxylate
CAS Number: 1017781-49-5
Product Number: AG0005HX(AGN-PC-086F2C)
Synonyms:
MDL No:
Molecular Formula: C19H24BrNO4
Molecular Weight: 410.3022

Identification/Properties


Computed Properties
Molecular Weight:
410.308g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
6
Exact Mass:
409.089g/mol
Monoisotopic Mass:
409.089g/mol
Topological Polar Surface Area:
63.7A^2
Heavy Atom Count:
25
Formal Charge:
0
Complexity:
498
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:
H302-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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