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CAS 351490-72-7

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Benzenepropanoic acid, 4-cyano-3-[(2R)-3-[[2-(2,3-dihydro-1H-inden-2-yl)-1,1-dimethylethyl]amino]-2-hydroxypropoxy]-, hydrochloride (1:1)

Description:
Benzenepropanoic acid, 4-cyano-3-[(2R)-3-[[2-(2,3-dihydro-1H-inden-2-yl)-1,1-dimethylethyl]amino]-2-hydroxypropoxy]-, hydrochloride (1:1), with CAS number 351490-72-7, is a complex organic compound characterized by its multi-functional structure. It features a benzene ring, a propanoic acid moiety, and a cyano group, indicating potential reactivity and biological activity. The presence of a hydroxypropoxy group suggests solubility in polar solvents, while the hydrochloride form indicates it is a salt, enhancing its stability and solubility in aqueous environments. This compound may exhibit pharmacological properties, potentially acting as a drug candidate due to its intricate structure, which includes an amino group that could facilitate interactions with biological targets. Its synthesis and characterization would typically involve standard organic chemistry techniques, and it may be of interest in medicinal chemistry or materials science. As with many complex organic compounds, safety and handling precautions are essential due to potential toxicity or reactivity.
Formula:C26H32N2O4·ClH
InChI:InChI=1S/C26H32N2O4.ClH/c1-26(2,14-19-11-20-5-3-4-6-21(20)12-19)28-16-23(29)17-32-24-13-18(8-10-25(30)31)7-9-22(24)15-27;/h3-7,9,13,19,23,28-29H,8,10-12,14,16-17H2,1-2H3,(H,30,31);1H/t23-;/m1./s1
InChI key:InChIKey=WVXHWCHBKCXTJA-GNAFDRTKSA-N
SMILES:C(C(NC[C@H](COC1=C(C#N)C=CC(CCC(O)=O)=C1)O)(C)C)C2CC=3C(C2)=CC=CC3.Cl
Synonyms:
  • Benzenepropanoic acid, 4-cyano-3-[(2R)-3-[[2-(2,3-dihydro-1H-inden-2-yl)-1,1-dimethylethyl]amino]-2-hydroxypropoxy]-, monohydrochloride
  • Benzenepropanoic acid, 4-cyano-3-[(2R)-3-[[2-(2,3-dihydro-1H-inden-2-yl)-1,1-dimethylethyl]amino]-2-hydroxypropoxy]-, hydrochloride (1:1)
  • (R)-3-[4-Cyano-3-[2-hydroxy-3-(2-indan-2-yl-1,1-dimethylethylamino)propoxy]phenyl]propionic acid hydrochloride
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