(Z)-7-[(1S,2S,3S,4R)-3-[[2-(phenylcarbamoyl)hydrazinyl]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]hept-5-enoic acid


Chemical Name: (Z)-7-[(1S,2S,3S,4R)-3-[[2-(phenylcarbamoyl)hydrazinyl]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]hept-5-enoic acid
CAS Number: 98672-91-4
Product Number: AG01EOU6(AGN-PC-00150G)
Synonyms:
MDL No: MFCD00153871
Molecular Formula: C21H29N3O4
Molecular Weight: 387.4727

Identification/Properties


Computed Properties
Molecular Weight:
387.48g/mol
XLogP3:
0.3
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
10
Exact Mass:
387.216g/mol
Monoisotopic Mass:
387.216g/mol
Topological Polar Surface Area:
99.7A^2
Heavy Atom Count:
28
Formal Charge:
0
Complexity:
548
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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Chemical Structure



The compound $name$ has valuable applications in chemical synthesis, specifically in the field of organic chemistry. (5Z)-7-[(1S,2R,3R,4R)-3-[[2-[(Phenylamino)carbonyl]hydrazinyl]methyl]-7-oxabicyclo[2.2.1]hept-2-yl]-5-heptenoic acid serves as a versatile building block in the creation of complex molecules due to its unique structural features. By strategically incorporating this compound into synthetic pathways, chemists can access novel chemical structures with potential utility in pharmaceuticals, materials science, and other sectors of the chemical industry. Its reactivity and stereochemical properties make it an indispensable tool for the design and construction of intricate molecular architectures.