1-Pentanone, 5-methoxy-1-[4-(trifluoromethyl)phenyl]-,O-(2-aminoethyl)oxime, (1Z)-, (2Z)-2-butenedioate (1:1)


Chemical Name: 1-Pentanone, 5-methoxy-1-[4-(trifluoromethyl)phenyl]-,O-(2-aminoethyl)oxime, (1Z)-, (2Z)-2-butenedioate (1:1)
CAS Number: 917096-37-8
Product Number: AG00GY0K(AGN-PC-0VUYMI)
Synonyms:
MDL No:
Molecular Formula: C15H21F3N2O2
Molecular Weight: 318.3346496

Identification/Properties


Computed Properties
Molecular Weight:
318.34g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
9
Exact Mass:
318.156g/mol
Monoisotopic Mass:
318.156g/mol
Topological Polar Surface Area:
56.8A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
327
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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Chemical Structure



(Z) Fluvoxamine, often utilized in chemical synthesis for its unique properties and reactivity, serves as a versatile building block for generating a wide range of complex organic compounds. This compound's chirality, stemming from the Z configuration, plays a crucial role in various asymmetric synthesis strategies, allowing for the creation of enantiomerically pure molecules with high stereocontrol. In addition, (Z) Fluvoxamine's functional groups enable efficient derivatization, facilitating the synthesis of novel pharmaceuticals, agrochemicals, and other fine chemicals. Its compatibility with various reaction conditions and its ability to participate in key transformations make it a valuable tool for synthetic chemists aiming to construct intricate molecular architectures with precision and efficiency.