1-(3-chlorophenyl)cyclopropane-1-carboxylic acid


Chemical Name: 1-(3-chlorophenyl)cyclopropane-1-carboxylic acid
CAS Number: 124276-34-2
Product Number: AG000LSK(AGN-PC-015QAS)
Synonyms:
MDL No: MFCD07374442
Molecular Formula: C10H9ClO2
Molecular Weight: 196.6303

Identification/Properties


Properties
BP:
350.3±35.0°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
196.63g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
196.029g/mol
Monoisotopic Mass:
196.029g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
223
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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Chemical Structure



1-(3-Chlorophenyl)cyclopropanecarboxylic acid is a versatile building block in chemical synthesis, commonly utilized in the pharmaceutical industry and agrochemical research. With its unique structure containing a chlorophenyl group attached to a cyclopropane ring, this compound offers a range of reactivity that makes it valuable for creating complex molecules.In chemical synthesis, 1-(3-Chlorophenyl)cyclopropanecarboxylic acid serves as a key intermediate in the production of various drugs, pesticides, and fine chemicals. Its cyclopropane moiety confers strained, reactive character, allowing for diverse transformation reactions to take place. Functionalization of the chlorophenyl group further enhances the compound's utility, enabling the introduction of specific properties or functionalities into the final product.By judiciously selecting reaction conditions and appropriate catalysts, chemists can exploit the unique reactivity of 1-(3-Chlorophenyl)cyclopropanecarboxylic acid to construct intricate molecular frameworks in a controlled manner. Its presence in synthetic routes facilitates the construction of bioactive compounds with tailored properties and improved biological activities.Overall, the strategic incorporation of 1-(3-Chlorophenyl)cyclopropanecarboxylic acid in chemical synthesis enables the efficient and selective construction of complex molecules, making it a valuable tool in the hands of synthetic chemists striving to develop novel pharmaceuticals and agrochemicals.