Ethanamine, 2-[(4-chlorophenyl)-2-pyridinylmethoxy]-N,N-dimethyl-,(2Z)-2-butenedioate (1:1)


Chemical Name: Ethanamine, 2-[(4-chlorophenyl)-2-pyridinylmethoxy]-N,N-dimethyl-,(2Z)-2-butenedioate (1:1)
CAS Number: 3505-38-2
Product Number: AG00I6XV(AGN-PC-0RAFAY)
Synonyms:
MDL No:
Molecular Formula: C20H23ClN2O5
Molecular Weight: 406.8600

Identification/Properties


Computed Properties
Molecular Weight:
406.863g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
8
Exact Mass:
406.13g/mol
Monoisotopic Mass:
406.13g/mol
Topological Polar Surface Area:
100A^2
Heavy Atom Count:
28
Formal Charge:
0
Complexity:
386
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
2811
Hazard Statements:
H301-H315-H319-H335
Precautionary Statements:
P261-P301+P310-P305+P351+P338
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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Chemical Structure



The compound Ethanamine, 2-[(4-chlorophenyl)-2-pyridinylmethoxy]-N,N-dimethyl-, (2Z)-2-butenedioate (1:1) is widely utilized in chemical synthesis as a key reagent for various reactions. Its versatile nature allows it to be employed in the development of intricate organic molecules, making it a valuable tool in the field of synthetic chemistry. This compound serves as a crucial building block in the creation of pharmaceuticals, agrochemicals, and materials with tailored properties. Its strategic placement within synthetic pathways enables the formation of complex structures with high efficiency and precision, making it a favored choice among chemists for a diverse range of applications.