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Substance Name: Diallyl disulfide
RN: 2179-57-9
UNII: 5HI47O6OA7
InChIKey: PFRGXCVKLLPLIP-UHFFFAOYSA-N

Note

  • Major constituent of garlic oil.

Molecular Formula

  • C6-H10-S2

Molecular Weight

  • 146.277
 

Classification Codes

  • Anticarcinogenic Agents
  • Antihypertensive Agents
  • Antimutagenic Agents
  • Antineoplastic Agents
  • Antispermatogenic Agents
  • Cardiovascular Agents
  • Contraceptive Agents
  • Contraceptive Agents, Female
  • Mutation Data
  • Noxae
  • Protective Agents
  • Reproductive Control Agents
  • Spermatocidal Agents
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Names and Synonyms

Name of Substance

  • Diallyl disulfide

Synonyms

  • 2-Propenyl disulfide
  • 2-Propenyl disulphide
  • 4,5-Dithia-1,7-octadiene
  • 4-01-00-02098 (Beilstein Handbook Reference)
  • AI3-35128
  • Allyl disulfide
  • Allyl disulphide
  • BRN 1699241
  • CCRIS 6290
  • Di(2-propenyl) disulfide
  • Diallyl disulfide
  • Diallyl disulphide
  • Disulfide, di-2-propenyl
  • EINECS 218-548-6
  • FEMA No. 2028
  • FEMA No. 3533
  • HSDB 595
  • NSC 29228
  • UNII-5HI47O6OA7

Systematic Names

  • Allyl disulfide
  • Diallyl disulfide
  • Diallyl disulphide
  • Disulfide, di-2-propen-1-yl
  • Disulfide, di-2-propenyl

Superlist Name

  • Allyl disulfide

Registry Numbers

CAS Registry Number

  • 2179-57-9

FDA UNII

  • 5HI47O6OA7

System Generated Number

  • 0002179579

Structure Descriptors

InChI

1S/C6H10S2/c1-3-5-7-8-6-4-2/h3-4H,1-2,5-6H2

InChIKey

PFRGXCVKLLPLIP-UHFFFAOYSA-N

Smiles

S(SCC=C)CC=C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin 3600mg/kg (3600mg/kg)   Food and Chemical Toxicology. Vol. 26, Pg. 297, 1988.
rat LD50 oral 260mg/kg (260mg/kg)   Food and Chemical Toxicology. Vol. 26, Pg. 297, 1988.