Cyclobutanecarboxylic acid, 1-(3-fluorophenyl)-


Chemical Name: Cyclobutanecarboxylic acid, 1-(3-fluorophenyl)-
CAS Number: 179411-84-8
Product Number: AG0026ZE(AGN-PC-00UY4L)
Synonyms:
MDL No:
Molecular Formula: C11H11FO2
Molecular Weight: 194.2022

Identification/Properties


Computed Properties
Molecular Weight:
194.205g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
194.074g/mol
Monoisotopic Mass:
194.074g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
235
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

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



1-(3-Fluorophenyl)cyclobutanecarboxylic acid is a versatile compound widely utilized in chemical synthesis due to its unique structural properties. As a potential building block in organic chemistry, this compound serves as a crucial intermediate in the production of various pharmaceuticals, agrochemicals, and fine chemicals. Its cyclobutane ring structure and substituted phenyl group offer opportunities for diverse functional group transformations, enabling the synthesis of complex molecules with specific biological or chemical properties. In medicinal chemistry, 1-(3-Fluorophenyl)cyclobutanecarboxylic acid plays a key role in the development of novel drug candidates targeting various diseases. Additionally, its presence in material science research allows for the design and fabrication of advanced materials with tailored properties. By incorporating this compound into synthetic routes, chemists can access a broad range of molecular structures, making it a valuable tool for advancing scientific innovation.