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Substance Name: 2,4-Di-sec-butylphenol
RN: 1849-18-9
UNII: 4S9NLO660D
InChIKey: JERZAOOJWPHIDG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H22-O

Molecular Weight

  • 206.327
 
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Names and Synonyms

Name of Substance

  • 2,4-Di-sec-butylphenol

Synonyms

  • 2,4-Di-sec-butylphenol
  • 4-06-00-03491 (Beilstein Handbook Reference)
  • BRN 2091118
  • EINECS 217-434-3
  • NSC 163957
  • UNII-4S9NLO660D

Systematic Names

  • 2,4-Di-sec-butylphenol
  • Phenol, 2,4-bis(1-methylpropyl)- (9CI)
  • Phenol, 2,4-di-sec-butyl-

Registry Numbers

CAS Registry Number

  • 1849-18-9

FDA UNII

  • 4S9NLO660D

System Generated Number

  • 0001849189

Structure Descriptors

InChI

1S/C14H22O/c1-5-10(3)12-7-8-14(15)13(9-12)11(4)6-2/h7-11,15H,5-6H2,1-4H3

InChIKey

JERZAOOJWPHIDG-UHFFFAOYSA-N

Smiles

c1(cc(ccc1O)[C@@H](CC)C)[C@@H](CC)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 120mg/kg (120mg/kg) BEHAVIORAL: SLEEP Journal of Medicinal Chemistry. Vol. 23, Pg. 1350, 1980.