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Substance Name: Ethyl thioglycolate
RN: 623-51-8
UNII: Z5SD8DD6CP
InChIKey: PVBRSNZAOAJRKO-UHFFFAOYSA-N

Molecular Formula

  • C4-H8-O2-S

Molecular Weight

  • 120.171
 
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Names and Synonyms

Name of Substance

  • Ethyl thioglycolate

Synonyms

  • 4-03-00-00616 (Beilstein Handbook Reference)
  • AI3-23030
  • BRN 0605581
  • EINECS 210-800-3
  • Ethyl 2-mercaptoacetate
  • Ethyl mercaptoacetate
  • Ethyl mercaptoacetic acid
  • Ethyl thioglycolate
  • Ethyl thioglycollate
  • Mercaptoacetic acid ethyl ester
  • NSC 8834
  • Thioglycolic acid ethyl ester
  • Thioglykolsaeure-aethylester
  • Thioglykolsaeure-aethylester [German]
  • UNII-Z5SD8DD6CP
  • USAF EK-2070

Systematic Names

  • Acetic acid, 2-mercapto-, ethyl ester
  • Acetic acid, mercapto-, ethyl ester
  • Ethyl mercaptoacetate

Registry Numbers

CAS Registry Number

  • 623-51-8

FDA UNII

  • Z5SD8DD6CP

System Generated Number

  • 0000623518

Structure Descriptors

InChI

1S/C4H8O2S/c1-2-6-4(5)3-7/h7H,2-3H2,1H3

InChIKey

PVBRSNZAOAJRKO-UHFFFAOYSA-N

Smiles

C(S)C(=O)OCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 100mg/kg (100mg/kg)   National Technical Information Service. Vol. AD277-689,
rat LD50 intraperitoneal 176mg/kg (176mg/kg)   Zeitschrift fuer die Gesamte Hygiene und Ihre Grenzgebiete. Vol. 20, Pg. 575, 1974.
rat LD50 oral 178mg/kg (178mg/kg)   Zeitschrift fuer die Gesamte Hygiene und Ihre Grenzgebiete. Vol. 20, Pg. 575, 1974.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 157 deg C   EXP
log P (octanol-water) 0.810 (none)   EST
Atmospheric OH Rate Constant 3.64E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.