Products 488787-59-3

CAS 488787-59-3 appears in our catalog under these names: (S)-4-(4-(Dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl)-3-(hydroxymethyl)benzonitrile, 95%, (S)-Citadiol. Offered by: Combi-blocks, Chemat Brand, Mikromol. Available pack sizes: 250mg, 1g, 100mg, on request, 25mg.

(S)-4-(4-(Dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl)-3-(hydroxymethyl)benzonitrile, 95%
Combi-blocks
  • size: 250mg, 1g, 100mg
  • Variants: 3
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(S)-Citadiol
Chemat Brand, Mikromol
  • size: on request, 25mg
  • Variants: 2
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Structural formula: {0} (CAS {1})

4-[(1S)-4-(dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl]-3-(hydroxymethyl)benzonitrile (CAS 488787-59-3) is a chemical compound with the molecular formula C20H23FN2O2 and a molecular weight of 342.4 g/mol. IUPAC name: 4-[(1S)-4-(dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl]-3-(hydroxymethyl)benzonitrile. InChIKey: GNULRNVWXYXBQY-FQEVSTJZSA-N.

Identity
Molecular formulaC20H23FN2O2
Molecular weight342.4 g/mol
IUPAC name4-[(1S)-4-(dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl]-3-(hydroxymethyl)benzonitrile
InChIKeyGNULRNVWXYXBQY-FQEVSTJZSA-N
SMILESCN(C)CCC[C@](C1=CC=C(C=C1)F)(C2=C(C=C(C=C2)C#N)CO)O

Computed by PubChem (NCBI)

Synonyms: (S)-Citadiol, Citadiol, (S)-, Citalopram Impurity 15
Related forms of this compound
4-[4-(dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl]-3-(hydroxymethyl)benzonitrile C20H23FN2O2
4-[(1R)-4-(dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl]-3-(hydroxymethyl)benzonitrile C20H23FN2O2
Isomers (same molecular formula)
1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-3H-2-benzofuran-5-carboxamide C20H23FN2O2
(1S)-1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-3H-2-benzofuran-5-carboxamide C20H23FN2O2
(NE)-N-[[1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-3H-2-benzofuran-5-yl]methylidene]hydroxylamine C20H23FN2O2