Cyclopropaneacetic acid,1-[[[(1R)-1-[3-[(1E)-2-(7-chloro-2-quinolinyl)ethenyl]phenyl]-3-[2-(1-methylethenyl)phenyl]propyl]thio]methyl]-


Chemical Name: Cyclopropaneacetic acid,1-[[[(1R)-1-[3-[(1E)-2-(7-chloro-2-quinolinyl)ethenyl]phenyl]-3-[2-(1-methylethenyl)phenyl]propyl]thio]methyl]-
CAS Number: 918972-54-0
Product Number: AG00GX6P(AGN-PC-0VX346)
Synonyms:
MDL No:
Molecular Formula: C35H34ClNO2S
Molecular Weight: 568.16796

Identification/Properties


Properties
MP:
>153°C (dec.)
Storage:
-10 ℃;Inert atmosphere;
Form:
Solid
Computed Properties
Molecular Weight:
568.172g/mol
XLogP3:
9.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
12
Exact Mass:
567.2g/mol
Monoisotopic Mass:
567.2g/mol
Topological Polar Surface Area:
75.5A^2
Heavy Atom Count:
40
Formal Charge:
0
Complexity:
887
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



The compound (R,E)-2-(1-(((1-(3-(2-(7-Chloroquinolin-2-yl)vinyl)phenyl)-3-(2-(prop-1-en-2-yl)phenyl)propyl)thio)methyl)cyclopropyl)acetic acid, also known as $name$, serves as a versatile building block in organic chemical synthesis. It plays a crucial role in the creation of complex molecules by serving as a key intermediate in various synthetic pathways.$name$ is commonly utilized in the synthesis of drug molecules, agrochemicals, and advanced materials due to its unique structure and functional groups. The cyclopropylacetic acid core of $name$ provides a rigid and chiral framework that enables precise stereochemical control in synthetic reactions.In chemical synthesis, $name$ can be functionalized at different sites to introduce specific functional groups or modify its reactivity, making it a valuable tool for designing and constructing diverse organic compounds. Its ability to participate in a wide range of reactions, such as cross-coupling, oxidation, and reduction, allows chemists to access a variety of target molecules efficiently.Overall, the strategic incorporation of (R,E)-2-(1-(((1-(3-(2-(7-Chloroquinolin-2-yl)vinyl)phenyl)-3-(2-(prop-1-en-2-yl)phenyl)propyl)thio)methyl)cyclopropyl)acetic acid in chemical synthesis enables the synthesis of complex and structurally diverse compounds, contributing to the advancement of pharmaceuticals, materials science, and other fields of research.