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Compound Summary

General Compound Information

dimethyl trisulfide

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Description

Dimethyl trisulfide is an organic trisulfide.

Synonyms

Dimethyl trisulfide; 3658-80-8; Trisulfide, dimethyl; Methyl trisulfide; 2,3,4-Trithiapentane;

(methyltrisulfanyl)methane;DIMETHYLTRISULFIDE;Dimethyl trisulphide;dimethyltrisulfane;DMTS;FEMA No. 3275;CH3SSSCH3;3E691T3NL1;NSC-97324;UNII-3E691T3NL1;Dimethyl trisufide;EINECS 222-910-9;2,4-Trithiapentane;NSC 97324;trisulfane, dimethyl-;1,3-Dimethyltrisulfane;AI3-26172;Dimethyl Trisulfide-[d6];1,3-Dimethyltrisulfane #;SCHEMBL446658;methylsulfanyldisulfanyl-methane;CHEBI:4614;DTXSID9063118;DIMETHYL TRISULFIDE [FHFI];Dimethyl trisulfide, >=98%, FG;NSC97324;MFCD00039808;NSC801680;s6311;AKOS015897465;NSC-801680;Dimethyl trisulfide, analytical standard;BS-43830;1,3-Dimethyltrisulfane (ACD/Name 4.0);DB-003633;HY-128454;CS-0099182;D3418;FT-0625104;FT-0667568;C08372;D90187;A823301;Q-100435;Q5277321;FLAMMABLE LIQUID, N.O.S. (DIMETHYL TRISULPHIDE);

FlavorDB ID

2593

PUBCHEM ID

Molecular Weight

126.3 Molecular Formula

C2H6S3

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IUPAC Inchikey

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Similarity

CATEGORY	QUALITY	THRESHOLD	OCCURENCE	REFERENCE
smell	cabbage-like	7.838e-5 µmol/L		details
smell	cabbage-like	1.267e-4 µmol/L		details
smell		1.584e-3 µmol/L	durian	details
smell	cabbage-like	7.838e-5 µmol/L	mango	details
smell	cabbage-like	7.838e-4 µmol/L	pan-fried shiitake mushroom	details
smell	decaying vegetation, swampy, putrid, garlic		water	details
smell	decaying vegetation, swampy, putrid, garlic	7.939e-5 µmol/L	water	details

Toxicity Summary
Link to the Distributed Structure-Searchable Toxicity (DSSTox) Database

Food Additive Safety (OFAS)
DIMETHYL TRISULFIDE is used for FLAVORING AGENT OR ADJUVANT. More food additive safty information please view GRAS report.

EFSA's chemical Hazards Database : OpenFoodTox
This compound is found in OpenFoodTox with the name: Dimethyl trisulfide

Reference point : Defined point on an experimental dose–response relationship for the critical effect. This term is synonymous to Point of departure (USA). Reference points include the lowest or no observed adverse effect level (LOAEL/NOAEL) or benchmark dose lower confidence limit (BDML), used to derive a reference value or Margin of Exposure in human and animal health risk assessment. In the ecological area, these include lethal dose (LD50), effect concentration (EC5/ECx), no (adverse) effect concentration/dose (NOEC/NOAEC/NOAED), no (adverse) effect level (NEL/NOAEL), hazard concentration (HC5/HCx) derived from a Species Sensitivity Distributions (SSD) for the ecosystem (EFSA Scientific Committee,2018). Citation: DOI 10.5281/zenodo.4740174

Reference point information of this compound is not available!

Reference Value

Reference Value : The estimated maximum dose (on a body mass basis) or the concentration of an agent to which an individual may be exposed over a specified period without appreciable risk. Reference values are established by applying an uncertainty factor to the reference point. Examples of reference values in human health include acceptable daily intake (ADI) for food and feed additives, and pesticides, tolerable upper intake levels (UL) for vitamins and minerals, and tolerable daily intake (TDI) for contaminants and food contact materials. For acute effects and operators, the acute reference dose (ARfD) and the acceptable operator exposure level (AOEL). In animal health and the ecological area, these include safe feed concentrations and the Predicted no effect concentration (PNEC) respectively (EFSA Scientific Committee, 2018). Citation: DOI 10.5281/zenodo.4740174

OUTPUT ID	ASSESSMENT	QUALIFIER	VALUE	UNIT	POPULATION
2224	MSI/FC	=	0.3	mg/kg	Pigs
2224	MSI/FC	=	0.3	mg/kg	Poultry
2224	MSI/FC	=	0.5	mg/kg	Animal not used for food production - unspecified
2224	MSI/FC	=	0.5	mg/kg	Cattle
2224	MSI/FC	=	0.5	mg/kg	Salmons

Genotoxicity

Author	YEAR	OUTPUT ID	Genotoxicity
EFSA CEF	2011	2066	Not determined
EFSA CEF	2011	2120	Not determined
EFSA CEF	2014	2499	Not determined
EFSA CEF	2018	3043	Not determined
EFSA FEEDAP	2013	2224	No data

EFSA Outputs

Output ID	Title	DOI	Published
2066	Scientific Opinion on Flavouring Group Evaluation 74, Revision 1 (FGE.74Rev1): Consideration of Simple Aliphatic Sulphides and Thiols evaluated by the JECFA (53rd and 61st meeting) Structurally related to Aliphatic and Alicyclic Mono-, Di-, Tri-, and Polysulphides with or without Additional Oxygenated Functional Groups from Chemical Group 20 evaluated by EFSA in FGE.08Rev1 (2009).	doi:10.2903/j.efsa.2011.1842	07Mar2011
2120	Scientific Opinion on Flavouring Group Evaluation 74, Revision 2 (FGE.74Rev2): Consideration of Simple Aliphatic Sulphides and Thiols evaluated by the JECFA (53rd and 61st meeting) Structurally related to Aliphatic and Alicyclic Mono-, Di-, Tri-, and Polysulphides with or without Additional Oxygenated Functional Groups from Chemical Group 20 evaluated by EFSA in FGE.08Rev3 (2011).	doi:10.2903/j.efsa.2011.2458	19Dec2011
2224	Scientific Opinion on the safety and efficacy of aliphatic and aromatic mono- and di-thiols and mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups (chemical group 20) when used as flavourings for all animal species	doi:10.2903/j.efsa.2013.3208	13May2013
2499	Scientific Opinion on Flavouring Group Evaluation 74, Revision 3 (FGE.74Rev3): Consideration of Simple Aliphatic Sulphides and Thiols evaluated by the JECFA (53rd and 61st meeting) Structurally related to Aliphatic and Alicyclic Mono-, Di-, Tri-, and Polysulphides with or without Additional Oxygenated Functional Groups from Chemical Group 20 evaluated by EFSA in FGE.08Rev5 (2012)	doi:10.2903/j.efsa.2014.3710	13Jun2014
3043	Scientific Opinion on Flavouring Group Evaluation 74, Revision 4 (FGE.74Rev4): Consideration of aliphatic sulphides and thiols evaluated by JECFA (53rd and 61st meeting) structurally related to aliphatic and alicyclic mono-, di-, tri- and polysulphides with or without additional oxygenated functional groups from chemical group 20 evaluated by EFSA in FGE.08Rev5	doi:10.2903/j.efsa.2018.5167	20Mar2018

Receptors

Receptor information of this compound is not available!

Consensus Spectra

Spectrum Type	Spectrum View	Description	Polarity
Experimental GCMS	view	GCMS	positive

Content

Compound Summary

dimethyl trisulfide

Description

Dimethyl trisulfide is an organic trisulfide.

Synonyms

Dimethyl trisulfide; 3658-80-8; Trisulfide, dimethyl; Methyl trisulfide; 2,3,4-Trithiapentane;

FlavorDB ID

2593

PUBCHEM ID

19310

Molecular Weight

126.3

Molecular Formula

C2H6S3

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Content

Compound Summary

dimethyl trisulfide

Description

Dimethyl trisulfide is an organic trisulfide.

Synonyms

Dimethyl trisulfide; 3658-80-8; Trisulfide, dimethyl; Methyl trisulfide; 2,3,4-Trithiapentane;

FlavorDB ID

2593

PUBCHEM ID

19310

Molecular Weight

126.3

Molecular Formula

C2H6S3

Openeye Can Smiles

CSSSC

IUPAC Inchikey

YWHLKYXPLRWGSE-UHFFFAOYSA-N

Network

Shown in network

Similarity

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Reference Details

Reference Details

Reference Details

Reference Details

Reference Details

Reference Details

Reference Details

OpenFoodTox: component Dimethyl trisulfide

GC-MS Spectrum