4-Pentenoicacid, 2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-5-phenyl-, [S-(E)]- (9CI)


Chemical Name: 4-Pentenoicacid, 2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-5-phenyl-, [S-(E)]- (9CI)
CAS Number: 159610-82-9
Product Number: AG001R7M(AGN-PC-0Q7OPH)
Synonyms:
MDL No:
Molecular Formula: C26H23NO4
Molecular Weight: 413.4651

Identification/Properties


Computed Properties
Molecular Weight:
413.473g/mol
XLogP3:
5.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
8
Exact Mass:
413.163g/mol
Monoisotopic Mass:
413.163g/mol
Topological Polar Surface Area:
75.6A^2
Heavy Atom Count:
31
Formal Charge:
0
Complexity:
619
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
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-H320-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



(S,E)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-5-phenylpent-4-enoic acid, also known as $name$, is a versatile chemical compound commonly employed in chemical synthesis processes. This compound serves as a key building block in the creation of various pharmaceuticals, agrochemicals, and specialty chemicals due to its unique structural properties and reactivity.In chemical synthesis, (S,E)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-5-phenylpent-4-enoic acid plays a crucial role as a reactive intermediate for the synthesis of complex organic molecules. Its functional groups allow for efficient manipulation of the molecule to introduce different substituents, enabling the creation of diverse chemical structures with specific properties.Furthermore, the optical purity of (S,E)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-5-phenylpent-4-enoic acid makes it particularly valuable in the synthesis of chiral compounds, where stereochemical control is essential for the desired biological activity or material properties. This compound's ability to participate in various bond-forming reactions and functional group transformations makes it a versatile and indispensable tool for organic chemists working in the field of chemical synthesis.