Floctafenine

CAS Registry Number®

23779-99-9
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CAS Name

Floctafenine

Molecular Formula

C20H17F3N2O4

Molecular Mass

406.36

Cite this Page

Floctafenine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=23779-99-9 (retrieved 2024-04-20) (CAS RN: 23779-99-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    179.5 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C20H17F3N2O4/c21-20(22,23)15-6-3-5-13-17(8-9-24-18(13)15)25-16-7-2-1-4-14(16)19(28)29-11-12(27)10-26/h1-9,12,26-27H,10-11H2,(H,24,25)

InChIKey

InChIKey=APQPGQGAWABJLN-UHFFFAOYSA-N

SMILES

C(F)(F)(F)C=1C2=C(C(NC3=C(C(OCC(CO)O)=O)C=CC=C3)=CC=N2)C=CC1

Canonical SMILES

O=C(OCC(O)CO)C=1C=CC=CC1NC=2C=CN=C3C2C=CC=C3C(F)(F)F

Other Names for this Substance

  • Benzoic acid, 2-[[8-(trifluoromethyl)-4-quinolinyl]amino]-, 2,3-dihydroxypropyl ester
  • Anthranilic acid, N-[8-(trifluoromethyl)-4-quinolyl]-, 2,3-dihydroxypropyl ester
  • Glycerol, 1-[N-[8-(trifluoromethyl)-4-quinolyl]anthranilate]
  • Floctafenin
  • Floctafenine

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