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Substance Name: beta,beta'-Thiodipropionitrile
RN: 111-97-7
UNII: AUN83T85KS
InChIKey: NDVLTZFQVDXFAN-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C6-H8-N2-S

Molecular Weight

  • 140.209
 
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Names and Synonyms

Name of Substance

  • beta,beta'-Thiodipropionitrile

Synonyms

  • 2,2'-Thiodiethylkyanid
  • 2,2'-Thiodiethylkyanid [Czech]
  • 2-Cyanoethyl sulfide
  • 3,3'-Thiodipropionitrile
  • 4-03-00-00749 (Beilstein Handbook Reference)
  • AI3-16840
  • beta,beta'-Dicyanodiethyl sulfide
  • beta,beta'-Thiodipropionitrile
  • Bis(2-cyanoethyl) sulfide
  • BRN 1701139
  • Di(2-cyanoethyl)sulfide
  • Dicyanoethyl sulfide
  • EINECS 203-926-5
  • Nitril kyseliny beta,beta'-thiodipropionove
  • Nitril kyseliny beta,beta'-thiodipropionove [Czech]
  • NSC 2040
  • Sulfide, bis(2-cyanoethyl)
  • UNII-AUN83T85KS
  • USAF HA-5

Systematic Names

  • 3,3'-Thiodipropiononitrile
  • Propanenitrile, 3,3'-thiobis-
  • Propionitrile, 3,3'-thiodi-

Superlist Names

  • beta,beta'-Thiodipropionitrile
  • Propionitrile, 3,3'-thiodi-

Registry Numbers

CAS Registry Number

  • 111-97-7

FDA UNII

  • AUN83T85KS

System Generated Number

  • 0000111977

Structure Descriptors

InChI

1S/C6H8N2S/c7-3-1-5-9-6-2-4-8/h1-2,5-6H2

InChIKey

NDVLTZFQVDXFAN-UHFFFAOYSA-N

Smiles

S(CCC#N)CCC#N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 300mg/kg (300mg/kg)   National Technical Information Service. Vol. AD277-689,
rabbit LD50 skin 4500mg/kg (4500mg/kg)   Journal of Industrial Hygiene and Toxicology. Vol. 31, Pg. 60, 1949.
rat LD50 oral 4210mg/kg (4210mg/kg)   Journal of Industrial Hygiene and Toxicology. Vol. 31, Pg. 60, 1949.