4′-Ethyl 3-chloro-3′-fluoro[1,1′-biphenyl]-4,4′-dicarboxylate

CAS Registry Number®

1261994-87-9
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CAS Name

4′-Ethyl 3-chloro-3′-fluoro[1,1′-biphenyl]-4,4′-dicarboxylate

Molecular Formula

C16H12ClFO4

Molecular Mass

322.72

Cite this Page

4′-Ethyl 3-chloro-3′-fluoro[1,1′-biphenyl]-4,4′-dicarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1261994-87-9 (retrieved 2024-09-06) (CAS RN: 1261994-87-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H12ClFO4/c1-2-22-16(21)12-6-4-10(8-14(12)18)9-3-5-11(15(19)20)13(17)7-9/h3-8H,2H2,1H3,(H,19,20)

InChIKey

InChIKey=SODWNSWQGMLRSH-UHFFFAOYSA-N

SMILES

FC=1C=C(C=CC1C(OCC)=O)C2=CC(Cl)=C(C(O)=O)C=C2

Canonical SMILES

O=C(O)C=1C=CC(=CC1Cl)C2=CC=C(C(=O)OCC)C(F)=C2

Other Names for this Substance

  • [1,1′-Biphenyl]-4,4′-dicarboxylic acid, 3-chloro-3′-fluoro-, 4′-ethyl ester
  • 4′-Ethyl 3-chloro-3′-fluoro[1,1′-biphenyl]-4,4′-dicarboxylate