(1S,2S)-2-fluoro-2-phenylcyclopropane-1-carboxylic acid


Chemical Name: (1S,2S)-2-fluoro-2-phenylcyclopropane-1-carboxylic acid
CAS Number: 914221-42-4
Product Number: AG00H17D(AGN-PC-007X0X)
Synonyms:
MDL No:
Molecular Formula: C10H9FO2
Molecular Weight: 180.1757

Identification/Properties


Computed Properties
Molecular Weight:
180.178g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
180.059g/mol
Monoisotopic Mass:
180.059g/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:
2
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:
H302-H315-H319-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



2-Fluoro-2-phenylcyclopropanecarboxylic acid is a versatile building block in chemical synthesis due to its unique structural properties. This compound can serve as a valuable starting material for the preparation of various biologically active molecules and pharmaceutical intermediates. Its incorporation into organic synthesis reactions can lead to the formation of novel compounds with enhanced pharmacological properties. Additionally, the fluoro substituent on the cyclopropane ring can impart desirable physicochemical characteristics to the final products, making this acid an important tool for medicinal chemistry research and drug development.