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Substance Name: Thioguaiacol
RN: 7217-59-6
UNII: 90HAL41673
InChIKey: DSCJETUEDFKYGN-UHFFFAOYSA-N

Molecular Formula

  • C7-H8-O-S

Molecular Weight

  • 140.205
 
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Names and Synonyms

Name of Substance

  • Thioguaiacol

Synonyms

  • 2-Methoxybenzenethiol
  • 2-Methoxythiophenol
  • 4-06-00-05633 (Beilstein Handbook Reference)
  • BRN 2042178
  • EINECS 230-605-7
  • o-Methoxybenzenethiol
  • Thioguaiacol
  • UNII-90HAL41673

Systematic Names

  • 2-Methoxybenzenethiol
  • Benzenethiol, 2-methoxy-
  • Benzenethiol, o-methoxy-

Registry Numbers

CAS Registry Number

  • 7217-59-6

FDA UNII

  • 90HAL41673

System Generated Number

  • 0007217596

Structure Descriptors

InChI

InChI=1S/C7H8OS/c1-8-6-4-2-3-5-7(6)9/h2-5,9H,1H3

InChIKey

DSCJETUEDFKYGN-UHFFFAOYSA-N

Smiles

COc1ccccc1S

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1560mg/kg (1560mg/kg) BEHAVIORAL: ATAXIA

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION
Food and Cosmetics Toxicology. Vol. 19, Pg. 753, 1981.
rat LD50 oral 1740mg/kg (1740mg/kg) BEHAVIORAL: ATAXIA

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION
Food and Cosmetics Toxicology. Vol. 19, Pg. 753, 1981.