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Substance Name: o-Cresol, 4-tert-butyl-alpha-(p-chlorophenyl)-
RN: 20121-09-9
InChIKey: GMXYMQVEBDBUGZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H19-Cl-O

Molecular Weight

  • 274.789
 
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Names and Synonyms

Synonyms

  • 2-(4'-Chlorobenzyl)-4-t-butylphenol
  • 4-tert-Butyl-alpha-(p-chlorophenyl)-o-cresol

Systematic Name

  • o-Cresol, 4-tert-butyl-alpha-(p-chlorophenyl)-

Registry Numbers

CAS Registry Number

  • 20121-09-9

System Generated Number

  • 0020121099

Structure Descriptors

InChI

1S/C17H19ClO/c1-17(2,3)14-6-9-16(19)13(11-14)10-12-4-7-15(18)8-5-12/h4-9,11,19H,10H2,1-3H3

InChIKey

GMXYMQVEBDBUGZ-UHFFFAOYSA-N

Smiles

c1(c(cc(cc1)C(C)(C)C)Cc1ccc(cc1)Cl)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1900mg/kg (1900mg/kg)   United States Patent Document. Vol. #3984482,