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Substance Name: 4-Bromo-2,6-xylenol
RN: 2374-05-2
UNII: PE2VSV8GBM
InChIKey: ZLVFYUORUHNMBO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H9-Br-O

Molecular Weight

  • 201.062
 
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Names and Synonyms

Name of Substance

  • 4-Bromo-2,6-xylenol

Synonyms

  • 2,6-Xylenol, 4-bromo-
  • 3-06-00-01738 (Beilstein Handbook Reference)
  • 4-Bromo-2,6-dimethylphenol
  • 4-Bromo-2,6-xylenol
  • BRN 1862399
  • EINECS 219-153-1
  • NSC 63922
  • Phenol, 4-bromo-2,6-dimethyl-
  • UNII-PE2VSV8GBM

Systematic Names

  • 2,6-Xylenol, 4-bromo-
  • 4-Bromo-2,6-xylenol
  • Phenol, 4-bromo-2,6-dimethyl-

Registry Numbers

CAS Registry Number

  • 2374-05-2

FDA UNII

  • PE2VSV8GBM

System Generated Number

  • 0002374052

Structure Descriptors

InChI

1S/C8H9BrO/c1-5-3-7(9)4-6(2)8(5)10/h3-4,10H,1-2H3

InChIKey

ZLVFYUORUHNMBO-UHFFFAOYSA-N

Smiles

c1(c(cc(Br)cc1C)C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 650mg/kg (650mg/kg)   Journal of Medicinal and Pharmaceutical Chemistry. Vol. 2, Pg. 201, 1960.