Ethyl 5-bromo-2-(4-fluorophenyl)-6-nitro-3-benzofurancarboxylate

CAS Registry Number®

1333340-14-9
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CAS Name

Ethyl 5-bromo-2-(4-fluorophenyl)-6-nitro-3-benzofurancarboxylate

Molecular Formula

C17H11BrFNO5

Molecular Mass

408.18

Cite this Page

Ethyl 5-bromo-2-(4-fluorophenyl)-6-nitro-3-benzofurancarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1333340-14-9 (retrieved 2024-08-01) (CAS RN: 1333340-14-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    139.2 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C17H11BrFNO5/c1-2-24-17(21)15-11-7-12(18)13(20(22)23)8-14(11)25-16(15)9-3-5-10(19)6-4-9/h3-8H,2H2,1H3

InChIKey

InChIKey=PNADZXBALPWPEG-UHFFFAOYSA-N

SMILES

C(OCC)(=O)C=1C=2C(OC1C3=CC=C(F)C=C3)=CC(N(=O)=O)=C(Br)C2

Canonical SMILES

O=C(OCC)C1=C(OC2=CC(=C(Br)C=C21)N(=O)=O)C=3C=CC(F)=CC3

Other Names for this Substance

  • 3-Benzofurancarboxylic acid, 5-bromo-2-(4-fluorophenyl)-6-nitro-, ethyl ester
  • Ethyl 5-bromo-2-(4-fluorophenyl)-6-nitro-3-benzofurancarboxylate