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CAS 1447942-40-6

:

(1α,3α,5α)-6,6-Difluorobicyclo[3.1.0]hexane-3-carboxylic acid

Description:
(1α,3α,5α)-6,6-Difluorobicyclo[3.1.0]hexane-3-carboxylic acid is a bicyclic compound characterized by its unique structural framework, which includes a bicyclo[3.1.0]hexane core with two fluorine atoms attached to the carbon atoms at the 6-position. The presence of the carboxylic acid functional group at the 3-position contributes to its acidic properties and potential reactivity. This compound is notable for its stereochemistry, indicated by the 1α, 3α, and 5α designations, which refer to the specific three-dimensional arrangement of atoms around the chiral centers. The difluorination enhances its chemical stability and may influence its biological activity, making it of interest in medicinal chemistry and material science. Additionally, the compound's unique structure may impart specific physical properties, such as solubility and melting point, which are important for its application in various chemical contexts. Overall, this compound exemplifies the complexity and diversity of bicyclic structures in organic chemistry.
Formula:C7H8F2O2
InChI:InChI=1/C7H8F2O2/c8-7(9)4-1-3(6(10)11)2-5(4)7/h3-5H,1-2H2,(H,10,11)/t3-,4-,5+
InChI key:InChIKey=IOQVITCQIHHDBC-ZGQXEFDQNA-N
SMILES:FC1(F)[C@@]2([C@]1(C[C@@H](C(O)=O)C2)[H])[H]
Synonyms:
  • Bicyclo[3.1.0]hexane-3-carboxylic acid, 6,6-difluoro-, (1α,3α,5α)-
  • (1α,3α,5α)-6,6-Difluorobicyclo[3.1.0]hexane-3-carboxylic acid
  • (1R,3s,5S)-6,6-difluorobicyclo[3.1.0]hexane-3-carboxylic acid
  • (1R,3s,5S)-rel-6,6-difluorobicyclo[3.1.0]hexane-3-carboxylic acid
  • TRANS-6,6-DIFLUOROBICYCLO[3.1.0]HEXANE-3-CARBOXYLIC ACID
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