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CAS 129050-29-9

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(αS,2S)-6-Fluoro-3,4-dihydro-α-[[(phenylmethyl)amino]methyl]-2H-1-benzopyran-2-methanol

Description:
The chemical substance known as (αS,2S)-6-Fluoro-3,4-dihydro-α-[[(phenylmethyl)amino]methyl]-2H-1-benzopyran-2-methanol, with the CAS number 129050-29-9, is a synthetic compound that belongs to the class of benzopyran derivatives. It features a complex molecular structure characterized by a benzopyran core, which is a fused ring system containing both aromatic and heterocyclic components. The presence of a fluorine atom at the 6-position contributes to its unique chemical properties, potentially influencing its biological activity and pharmacological profile. The compound also contains an amino group linked to a phenylmethyl moiety, which may enhance its interaction with biological targets. This substance is of interest in medicinal chemistry, particularly for its potential therapeutic applications. Its stereochemistry, indicated by the (αS,2S) configuration, suggests specific spatial arrangements that can significantly affect its biological activity and interactions. As with many synthetic organic compounds, its solubility, stability, and reactivity are influenced by its functional groups and overall molecular architecture.
Formula:C18H20FNO2
InChI:InChI=1S/C18H20FNO2/c19-15-7-9-17-14(10-15)6-8-18(22-17)16(21)12-20-11-13-4-2-1-3-5-13/h1-5,7,9-10,16,18,20-21H,6,8,11-12H2/t16-,18-/m0/s1
InChI key:InChIKey=UWHPUMRASBVSQY-WMZOPIPTSA-N
SMILES:[C@@H](CNCC1=CC=CC=C1)(O)[C@]2(OC=3C(CC2)=CC(F)=CC3)[H]
Synonyms:
  • 2H-1-Benzopyran-2-methanol, 6-fluoro-3,4-dihydro-α-[[(phenylmethyl)amino]methyl]-, (αS,2S)-
  • (αS,2S)-6-Fluoro-3,4-dihydro-α-[[(phenylmethyl)amino]methyl]-2H-1-benzopyran-2-methanol
  • 2H-1-Benzopyran-2-methanol, 6-fluoro-3,4-dihydro-α-[[(phenylmethyl)amino]methyl]-, [S-(R*,R*)]-
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