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Substance Name: Ditiocarb
RN: 147-84-2
UNII: 99Z2744345
InChIKey: LMBWSYZSUOEYSN-UHFFFAOYSA-N

Note

  • A chelating agent that has been used to mobilize toxic metals from the tissues of humans and experimental animals. It is the main metabolite of DISULFIRAM.

Molecular Formula

  • C5-H11-N-S2

Molecular Weight

  • 149.281
 

Classification Codes

  • Adjuvants, Immunologic
  • Anti-Infective Agents
  • Antiviral Agents
  • Chelating Agents
  • Immunologic Factors
  • Mutation Data
  • Sequestering Agents
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Names and Synonyms

Name of Substance

  • Ditiocarb

MeSH Heading

  • Ditiocarb

Synonyms

  • 4-04-00-00389 (Beilstein Handbook Reference)
  • BRN 1747741
  • CCRIS 7364
  • Diethyl dithiocarbamate
  • Diethylcarbamodithioic acid
  • Diethyldithiocarbamic acid
  • Diethyldithione
  • Ditiocarb
  • EINECS 205-701-7
  • OPC-12759
  • UNII-99Z2744345

Systematic Names

  • Carbamic acid, diethyldithio-
  • Carbamodithioic acid, diethyl-
  • Carbamodithioic acid, N,N-diethyl-
  • Diethyldithiocarbamic acid

Registry Numbers

CAS Registry Number

  • 147-84-2

FDA UNII

  • 99Z2744345

Other Registry Numbers

  • 17156-83-1
  • 942650-37-5

Related Registry Numbers

  • 148-18-5 (hydrochloride salt)
  • 20624-25-3 (hydrochloride salt, trihydrate)
  • 21124-33-4 (ammonium salt)
  • 34464-51-2 (bismuth salt)
  • 3699-30-7 (potassium-salt)

System Generated Number

  • 0000147842

Structure Descriptors

InChI

1S/C5H11NS2/c1-3-6(4-2)5(7)8/h3-4H2,1-2H3,(H,7,8)

InChIKey

LMBWSYZSUOEYSN-UHFFFAOYSA-N

Smiles

CCN(CC)C(S)=S

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD50 intravenous 1gm/kg (1000mg/kg) SENSE ORGANS AND SPECIAL SENSES: OTHER: EYE Pharmacologist. Vol. 3, Pg. 62, 1961.
mouse LD50 intraperitoneal 1gm/kg (1000mg/kg)   CRC Critical Reviews in Toxicology. Vol. 20, Pg. 83, 1989.
mouse LD50 intravenous 1750mg/kg (1750mg/kg)   Pharmacologist. Vol. 3, Pg. 62, 1961.
rat LD50 intravenous 1250mg/kg (1250mg/kg)   Pharmacologist. Vol. 3, Pg. 62, 1961.
rat LD50 oral 1gm/kg (1000mg/kg)   CRC Critical Reviews in Toxicology. Vol. 20, Pg. 83, 1989.