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Substance Name: 1-Benzopyrylium, 2-phenyl-, perchlorate
RN: 6272-41-9
InChIKey: CSMWYVFOQHXFMR-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H11-O.Cl-O4

Molecular Weight

  • 306.7
 
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Names and Synonyms

Synonyms

  • 2-Phenyl-1-benzopyrylium perchlorate
  • 2-Phenylbenzopyrylium perchlorate
  • 2-Phenylbenzopyrylium, 2-phenyl-, perchlorate
  • Flavylium perchlorate
  • NSC 37430

Systematic Names

  • 1-Benzopyrylium, 2-phenyl-, perchlorate
  • Flavylium, perchlorate (8CI)

Registry Numbers

CAS Registry Number

  • 6272-41-9

System Generated Number

  • 0006272419

Molecular Formulas

Molecular Formula

  • C15-H11-O.Cl-O4

Molecular Formula Fragments

  • C15-H11-O
  • Cl-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C15H11O.ClHO4/c1-2-6-12(7-3-1)15-11-10-13-8-4-5-9-14(13)16-15;2-1(3,4)5/h1-11H;(H,2,3,4,5)/q+1;/p-1

InChIKey

CSMWYVFOQHXFMR-UHFFFAOYSA-M

Smiles

[o+]1c2c(ccc1c1ccccc1)cccc2.Cl(=O)(=O)([O-])=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 470mg/kg (470mg/kg)   Journal of Heterocyclic Chemistry. Vol. 21, Pg. 193, 1984.
mouse LD50 oral 3200mg/kg (3200mg/kg)   Journal of Heterocyclic Chemistry. Vol. 21, Pg. 193, 1984.