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Substance Name: Phenol, 2,6-diisopropyl-4-methyl-
RN: 20766-99-8
InChIKey: PNTYWMCFKKJDAA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H20-O

Molecular Weight

  • 192.3
 
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Names and Synonyms

Synonyms

  • 2,6-Diisopropyl-4-methylphenol
  • 4-06-00-03469 (Beilstein Handbook Reference)
  • BRN 2089316
  • NSC 82343

Systematic Name

  • Phenol, 2,6-diisopropyl-4-methyl-

Registry Numbers

CAS Registry Number

  • 20766-99-8

System Generated Number

  • 0020766998

Structure Descriptors

InChI

1S/C13H20O/c1-8(2)11-6-10(5)7-12(9(3)4)13(11)14/h6-9,14H,1-5H3

InChIKey

PNTYWMCFKKJDAA-UHFFFAOYSA-N

Smiles

Cc1cc(c(c(c1)C(C)C)O)C(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 80mg/kg (80mg/kg) BEHAVIORAL: SLEEP Journal of Medicinal Chemistry. Vol. 23, Pg. 1350, 1980.