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Substance Name: 2,6-Dimethylol-p-cresol
RN: 91-04-3
UNII: Q99HT08S5N
InChIKey: KUMMBDBTERQYCG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H12-O3

Molecular Weight

  • 168.191
 
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Names and Synonyms

Name of Substance

  • 2,6-Dimethylol-p-cresol

Synonyms

  • 2,6-Bis(hydroxymethyl)-4-methylphenol
  • 2,6-Bis(hydroxymethyl)-p-cresol
  • 2,6-Di(hydroxymethyl)-p-cresol
  • 2,6-Dimethylol-4-methylphenol
  • 2,6-Dimethylol-p-cresol
  • 2-Hydroxy-5-methyl-1,3-benzenedimethanol
  • 4-06-00-07411 (Beilstein Handbook Reference)
  • alpha(sup 1),alpha(sup 3),2-Trihydroxymesitylene
  • alpha1,alpha,2-Trihydroxymesitylene
  • BRN 1240237
  • EINECS 202-036-4
  • NSC 15838
  • UNII-Q99HT08S5N

Systematic Names

  • 1,3-Benzenedimethanol, 2-hydroxy-5-methyl-
  • 3,5-Bis(hydroxymethyl)-p-cresol
  • alpha(sup 1),alpha(sup 3)-Mesitylenediol, 2-hydroxy- (7CI,8CI)
  • alpha1,alpha3-Mesitylenediol, 2-hydroxy- (8CI)

Registry Numbers

CAS Registry Number

  • 91-04-3

FDA UNII

  • Q99HT08S5N

Other Registry Number

  • 312714-78-6

System Generated Number

  • 0000091043

Structure Descriptors

InChI

1S/C9H12O3/c1-6-2-7(4-10)9(12)8(3-6)5-11/h2-3,10-12H,4-5H2,1H3

InChIKey

KUMMBDBTERQYCG-UHFFFAOYSA-N

Smiles

c1(c(c(cc(c1)C)CO)O)CO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
frog LDLo parenteral 1250mg/kg (1250mg/kg) SENSE ORGANS AND SPECIAL SENSES: MIOSIS (PUPILLARY CONSTRICTION): EYE

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX)
Journal of Pharmacology and Experimental Therapeutics. Vol. 26, Pg. 123, 1926.