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Substance Name: Trithioacetone
RN: 828-26-2
UNII: L0ME5B2ZWY
InChIKey: NBNWHQAWKFYFKI-UHFFFAOYSA-N

Molecular Formula

  • C9-H18-S3

Molecular Weight

  • 222.439
 
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Names and Synonyms

Name of Substance

  • Trithioacetone

Synonyms

  • 1,3,5-Trithiane, 2,2,4,4,6,6-hexamethyl-
  • 2,2,4,4,6,6-Hexamethyl-1,3,5-trithiane
  • 2,2,4,4,6,6-Hexamethyl-S-trithiane
  • 5-19-09-00119 (Beilstein Handbook Reference)
  • BRN 0106323
  • EINECS 212-582-5
  • FEMA No. 3475
  • Hexamethyl-1,3,5-trithiane
  • Hexamethyl-S-trithiane
  • s-Trithiane, 2,2,4,4,6,6-hexamethyl-
  • S-Trithiane, hexamethyl-
  • Trithioacetone
  • UNII-L0ME5B2ZWY

Systematic Names

  • 1,3,5-Trithiane, 2,2,4,4,6,6-hexamethyl-
  • 2,2,4,4,6,6-Hexamethyl-1,3,5-trithiane
  • s-Trithiane, 2,2,4,4,6,6-hexamethyl-

Superlist Name

  • Trithioacetone

Registry Numbers

CAS Registry Number

  • 828-26-2

FDA UNII

  • L0ME5B2ZWY

System Generated Number

  • 0000828262

Structure Descriptors

InChI

1S/C9H18S3/c1-7(2)10-8(3,4)12-9(5,6)11-7/h1-6H3

InChIKey

NBNWHQAWKFYFKI-UHFFFAOYSA-N

Smiles

C1(SC(SC(S1)(C)C)(C)C)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2400mg/kg (2400mg/kg)   Drug and Chemical Toxicology. Vol. 3, Pg. 249, 1980.