Rooperol

CAS Registry Number®

83644-00-2

CAS Name

Rooperol

Molecular Formula

C17H14O4

Molecular Mass

282.29

Cite this Page

Rooperol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=83644-00-2 (retrieved 2025-02-01) (CAS RN: 83644-00-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H14O4/c18-14-8-6-12(10-16(14)20)4-2-1-3-5-13-7-9-15(19)17(21)11-13/h2,4,6-11,18-21H,1H2/b4-2+

InChIKey

InChIKey=JQPOMMNEABQHEU-DUXPYHPUSA-N

SMILES

C(=C/CC#CC1=CC(O)=C(O)C=C1)\C2=CC(O)=C(O)C=C2

Canonical SMILES

OC1=CC=C(C#CCC=CC2=CC=C(O)C(O)=C2)C=C1O

Other Names for this Substance

  • 1,2-Benzenediol, 4,4′-[(1E)-1-penten-4-yne-1,5-diyl]bis-
  • 1,2-Benzenediol, 4,4′-(1-penten-4-yne-1,5-diyl)bis-, (E)-
  • 1,2-Benzenediol, 4,4′-[(E)-1-penten-4-yne-1,5-diyl]bis-
  • 4,4′-[(1E)-1-Penten-4-yne-1,5-diyl]bis[1,2-benzenediol]
  • trans-Rooperol

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Deleted or Replaced CAS Registry Numbers

171023-10-2