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Substance Name: Acetic acid, ((p-chlorophenyl)thio)-, compd. with 2,2'-iminobis(ethanol) (1:1)
RN: 87298-92-8
InChIKey: MWBHCFLEPCZMNG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H7-Cl-O2-S.C4-H11-N-O2

Molecular Weight

  • 307.796
 
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Names and Synonyms

Synonym

  • ((p-Chlorophenyl)thio)acetic acid 2,2'-iminodiethanol salt

Systematic Name

  • Acetic acid, ((p-chlorophenyl)thio)-, compd. with 2,2'-iminobis(ethanol) (1:1)

Registry Numbers

CAS Registry Number

  • 87298-92-8

System Generated Number

  • 0087298928

Molecular Formulas

Molecular Formula

  • C8-H7-Cl-O2-S.C4-H11-N-O2

Molecular Formula Fragments

  • C4-H11-N-O2
  • C8-H7-Cl-O2-S
  • COMPONENT

Structure Descriptors

InChI

1S/C8H7ClO2S.C4H11NO2/c9-6-1-3-7(4-2-6)12-5-8(10)11;6-3-1-5-2-4-7/h1-4H,5H2,(H,10,11);5-7H,1-4H2

InChIKey

MWBHCFLEPCZMNG-UHFFFAOYSA-N

Smiles

c1(ccc(cc1)Cl)SCC(=O)O.N(CCO)CCO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 unreported 3gm/kg (3000mg/kg)   Pharmaceutical Chemistry Journal Vol. 20, Pg. 180, 1986.
mouse LD50 intraperitoneal 1340mg/kg (1340mg/kg) BEHAVIORAL: SLEEP Russian Pharmacology and Toxicology Vol. 46, Pg. 150, 1983.