1-(2-Phenylethynyl)-1,2-benziodoxol-3(1H)-one

CAS Registry Number®

181934-31-6
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CAS Name

1-(2-Phenylethynyl)-1,2-benziodoxol-3(1H)-one

Molecular Formula

C15H9IO2

Molecular Mass

348.14

Cite this Page

1-(2-Phenylethynyl)-1,2-benziodoxol-3(1H)-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=181934-31-6 (retrieved 2024-08-23) (CAS RN: 181934-31-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    147-156 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C15H9IO2/c17-15-13-8-4-5-9-14(13)16(18-15)11-10-12-6-2-1-3-7-12/h1-9H

InChIKey

InChIKey=XOIXSZAJFLMMOS-UHFFFAOYSA-N

SMILES

C(#CC1=CC=CC=C1)I2C=3C(C(=O)O2)=CC=CC3

Canonical SMILES

O=C1OI(C#CC=2C=CC=CC2)C=3C=CC=CC13

Other Names for this Substance

  • 1,2-Benziodoxol-3(1H)-one, 1-(2-phenylethynyl)-
  • 1,2-Benziodoxol-3(1H)-one, 1-(phenylethynyl)-
  • 1-(2-Phenylethynyl)-1,2-benziodoxol-3(1H)-one
  • NSC 692392
  • 1-(Phenylethynyl)-1λ3-Benzo[d][1,2]iodaoxol-3(1H)-one

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