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Substance Name: 2-Decylthio-ethanol
RN: 41891-88-7
UNII: N56NUV4YDP
InChIKey: MWVYOMQTCFCPHY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H26-O-S

Molecular Weight

  • 218.402
 
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Names and Synonyms

Name of Substance

  • 2-Decylthio-ethanol

Synonyms

  • 2-Decylthioethanol
  • 2-Hydroxyethyl decyl sulfide
  • 2-N-Decylthioethanol
  • BRN 1849711
  • Decyl 2-hydroxyethyl sulfide
  • EINECS 255-576-8
  • Ethanol, 2-decylthio-
  • NSC 84188
  • UNII-N56NUV4YDP

Systematic Names

  • 2-(Decylthio)ethanol
  • Ethanol, 2-decylthio-

Registry Numbers

CAS Registry Number

  • 41891-88-7

FDA UNII

  • N56NUV4YDP

System Generated Number

  • 0041891887

Structure Descriptors

InChI

1S/C12H26OS/c1-2-3-4-5-6-7-8-9-11-14-12-10-13/h13H,2-12H2,1H3

InChIKey

MWVYOMQTCFCPHY-UHFFFAOYSA-N

Smiles

S(CCO)CCCCCCCCCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1500mg/kg (1500mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

BEHAVIORAL: IRRITABILITY
Pharmaceutical Chemistry Journal Vol. 19, Pg. 182, 1985.
mouse LD50 intravenous 100mg/kg (100mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#02135,