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Atomfair 2′-Bromo-6′-(dibutylamino)-3′-methylspiro[2-benzofuran-3,9′-xanthene]-1-one C29H30BrNO3 CAS 117342-26-4

2′-Bromo-6′-(dibutylamino)-3′-methylspiro[2-benzofuran-3,9′-xanthene]-1-one (CAS No. 117342-26-4) is a highly specialized spirocyclic organic compound with the molecular formula C29H30BrNO3. This compound features a unique spiro[2-benzofuran-3,9′-xanthene] core structure, functionalized with a bromo group, a dibutylamino moiety, and a methyl group, making it a valuable intermediate for advanced organic synthesis and materials science research. Its high purity and well-defined structure ensure reliability for applications in fluorescence studies, photochromic materials, and as a potential precursor for dyes and sensors. Suitable for researchers and scientists requiring precise chemical modifications, this product is available in various quantities to meet laboratory-scale and industrial needs.

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Description

2′-Bromo-6′-(dibutylamino)-3′-methylspiro[2-benzofuran-3,9′-xanthene]-1-one (CAS No. 117342-26-4) is a highly specialized spirocyclic organic compound with the molecular formula C29H30BrNO3. This compound features a unique spiro[2-benzofuran-3,9′-xanthene] core structure, functionalized with a bromo group, a dibutylamino moiety, and a methyl group, making it a valuable intermediate for advanced organic synthesis and materials science research. Its high purity and well-defined structure ensure reliability for applications in fluorescence studies, photochromic materials, and as a potential precursor for dyes and sensors. Suitable for researchers and scientists requiring precise chemical modifications, this product is available in various quantities to meet laboratory-scale and industrial needs.

Properties

  • CAS Number: 117342-26-4
  • Complexity: 709
  • IUPAC Name: 2′-bromo-6′-(dibutylamino)-3′-methyl-spiro[isobenzofuran-3,9′-xanthene]-1-one
  • InChI: InChI=1S/C29H30BrNO3/c1-4-6-14-31(15-7-5-2)20-12-13-23-27(17-20)33-26-16-19(3)25(30)18-24(26)29(23)22-11-9-8-10-21(22)28(32)34-29/h8-13,16-18H,4-7,14-15H2,1-3H3
  • InChI Key: XUPLAFJEGMCRDR-UHFFFAOYSA-N
  • Exact Mass: 519.14091
  • Molecular Formula: C29H30BrNO3
  • Molecular Weight: 520.5
  • SMILES: CCCCN(CCCC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C=C(C(=C5)Br)C
  • Topological: 38.8
  • Monoisotopic Mass: 519.14091
  • Synonyms: 117342-26-4, SCHEMBL27083121, XUPLAFJEGMCRDR-UHFFFAOYSA-N, DTXSID901130251, 2a(2)-Bromo-6a(2)-(dibutylamino)-3a(2)-methylspiro[isobenzofuran-1(3H),9a(2)-[9H]xanthen]-3-one

Application

This compound is primarily utilized in the development of photochromic and fluorescent materials due to its spirocyclic xanthene core. Researchers employ it in organic synthesis to create novel dyes and sensors with tunable optical properties. Its structural complexity also makes it a candidate for studying molecular switches and advanced functional materials.

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Disclaimer: Sold exclusively for laboratory research. Prohibited for commercial use, diagnostics, or human/animal applications. Buyers assume all compliance liability.

Disclaimer

Intended Use & Restrictions

This product is sold exclusively for laboratory research, analytical testing, or non-commercial purposes.

  • Strictly prohibited: Resale, repackaging, or formulation into commercial products.
  • Not approved for human/animal use, diagnostics, or manufacturing (including pharmaceuticals, agrochemicals, or consumer goods).

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Certain molecules may be protected by active patents or regulatory restrictions.

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  • Atomfair LLC does not provide legal assurances regarding patent non-infringement or jurisdictional compliance.

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  • Use this product only as permitted by law.
  • Indemnify Atomfair LLC against all claims arising from misuse, patent infringement, or regulatory violations.

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