Acetic acid, [1-(phenylmethyl)-4-piperidinylidene]-, ethyl ester


Chemical Name: Acetic acid, [1-(phenylmethyl)-4-piperidinylidene]-, ethyl ester
CAS Number: 40110-55-2
Product Number: AG0037W9(AGN-PC-0N3GMJ)
Synonyms:
MDL No:
Molecular Formula: C16H21NO2
Molecular Weight: 259.3434

Identification/Properties


Computed Properties
Molecular Weight:
259.349g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
5
Exact Mass:
259.157g/mol
Monoisotopic Mass:
259.157g/mol
Topological Polar Surface Area:
29.5A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
309
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#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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