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Substance Name: Benzoxazolium, 3-hexyl-2-(3-(3-hexyl-2(3H)-benzoxazolylidene)-1-propen-1-yl)-, iodide (1:1)
RN: 53213-82-4
InChIKey: XVLXYDXJEKLXHN-UHFFFAOYSA-M

Molecular Formula

  • C29-H37-N2-O2.I

Molecular Weight

  • 572.523
 
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Names and Synonyms

  • Benzoxazolium, 3-hexyl-2-(3-(3-hexyl-2(3H)-benzoxazolylidene)-1-propen-1-yl)-, iodide (1:1)
  • Benzoxazolium, 3-hexyl-2-(3-(3-hexyl-2(3H)-benzoxazolylidene)-1-propenyl)-, iodide

Registry Numbers

CAS Registry Number

  • 53213-82-4

Other Registry Numbers

  • 141608-95-9
  • 63596-48-5

Related Registry Number

  • 54501-79-0 (Parent)

System Generated Number

  • 0053213824

Molecular Formulas

Molecular Formula

  • C29-H37-N2-O2.I

Molecular Formula Fragments

  • C29-H37-N2-O2
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C29H37N2O2.HI/c1-3-5-7-13-22-30-24-16-9-11-18-26(24)32-28(30)20-15-21-29-31(23-14-8-6-4-2)25-17-10-12-19-27(25)33-29;/h9-12,15-21H,3-8,13-14,22-23H2,1-2H3;1H/q+1;/p-1

InChIKey

XVLXYDXJEKLXHN-UHFFFAOYSA-M

Smiles

C(C[n+]1c2ccccc2oc1\C=C/C=C1\Oc2ccccc2N1CCCCCC)CCCC.[IH-]