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allyl methyl disulphide

CAS 2179-58-0C4H8S2MW 120.2

allyl methyl disulphide (CAS 2179-58-0) — formula C4H8S2, molecular weight 120.2; category organic chemicals.

Product Description

allyl methyl disulphide (CAS 2179-58-0) is a organic chemicals. Its molecular formula C4H8S2 comprises 4 C, 8 H, 2 S atoms. Its molecular weight is about 120.2. Reported physicochemical data: boiling point around 30.00 to 33.00 °C. @ 20.00 mm Hg, LogP about 1.6. Organic chemicals are the largest family of carbon-based compounds, widely used across pharmaceuticals, agrochemicals, materials, cosmetics and food industries. Downstream uses span pharmaceutical ingredients, agrochemicals, dyes, solvents, surfactants, food additives and polymer materials. As a sourcing and distribution partner we help locate and compare this item across domestic and cross-border channels, arranging samples and batch orders with full COA and compliance files.

Product Overview

CAS Number2179-58-0
Molecular FormulaC4H8S2
Molecular Weight120.2
Boiling Point30.00 to 33.00 °C. @ 20.00 mm Hg
LogP1.6
Packaging25/50kg woven bags, 20/25/50kg fibre drums, 200kg plastic drums, 1000kg IBC (subject to order confirmation)
Applicationsagrochemicals, dyes, solvents, food additives and polymer materials. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering
CategoryOrganic Chemicals

Applications

Documented applications: agrochemicals, dyes, solvents, food additives and polymer materials. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering.

Packaging & Storage

Packaging25/50kg woven bags, 20/25/50kg fibre drums, 200kg plastic drums, 1000kg IBC (subject to order confirmation)

Technical Profile

What this product is

allyl methyl disulphide is a carbon-based organic compound with CAS registry number 2179-58-0 and molecular formula C4H8S2 (molecular weight 120.2), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 2179-58-0

Its molecular formula C4H8S2 comprises 4 C, 8 H, 2 S atoms.

Also known as: allyl methyl disulphide · 甲基烯丙基二硫 · Allyl Methyl Disulfide

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of allyl methyl disulphide?

The CAS registry number of allyl methyl disulphide is 2179-58-0.

What is the molecular formula and molecular weight of allyl methyl disulphide?

Molecular formula C4H8S2, molecular weight 120.2.

What other names is allyl methyl disulphide known by?

It is also registered under: allyl methyl disulphide, 甲基烯丙基二硫, Allyl Methyl Disulfide.

What are the documented applications of allyl methyl disulphide?

Recorded applications: agrochemicals, dyes, solvents, food additives and polymer materials. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering.

Which category does allyl methyl disulphide belong to?

Category: Organic Chemicals.

Packaging & documentation

Packaging is agreed per order, from lab-scale packs to bulk, and confirmed with each order rather than fixed on the page. A Certificate of Analysis (COA) ships with every batch and MSDS is available; where the end use carries a regulatory limit (food contact, pharmaceutical or cosmetic), state the standard at enquiry and the grade is set against it.

PubChem Public Data

Independent reference data for allyl methyl disulphide (CAS 2179-58-0), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number2179-58-0
PubChem CID62434
Molecular formulaC4H8S2
Molecular weight120.01 g/mol
IUPAC name3-(methyldisulfanyl)prop-1-ene
InChIKeyXNZOTQPMYMCTBZ-UHFFFAOYSA-N
UNII (FDA)OXW45UTR7B
ChEBI IDCHEBI:6854
FEMA number3127
JECFA number568

Computed descriptors

Molecular Weight120.2
XLogP31.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass120.00674260
Monoisotopic Mass120.00674260
Topological Polar Surface Area50.6
Heavy Atom Count6

Physicochemical values on record

Boiling Point30.00 to 33.00 °C. @ 20.00 mm Hg
Boiling Point83-84 °C (170 mm Hg); 30-33 °C (20 mm Hg)
Density0.927-0.933
Refractive Index1.533- 1.535

Documented uses on record

  • Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
  • Flavoring Agents -> JECFA Flavorings Index

Synonyms and trade names

ALLYL METHYL DISULFIDE; Methyl allyl disulfide; 2179-58-0; 3-(methyldisulfanyl)prop-1-ene; Allyl methyl disulphide; Methyl 2-propenyl disulfide; Disulfide, methyl 2-propenyl; OXW45UTR7B; FEMA No. 3127; DTXSID60176199; CHEBI:6854; RefChem:110878; DTXCID9098690; 218-549-1; methylallyl disulphide; 4,5-dithia-1-hexene

Regulatory listings held on file

Regulatory & Food ContactEU Flavoring substances
FDA Substance added to food: FLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT
Flavoring Agents
FLAVOURING_AGENT: Flavouring Agent
Green
No safety concern at current levels of intake when used as a flavouring agent

GHS hazard classification

Reported hazard statementsH225 (80%), H226 (20%), H302 (13.3%), H315 (13.3%), H319 (13.3%), H335 (13.3%)

H225 (80%): Highly Flammable liquid and vapor [Danger Flammable liquids]

H226 (20%): Flammable liquid and vapor [Warning Flammable liquids]

What the public record says

Allyl Methyl Disulfide is identified by CAS 2179-58-0, molecular formula C4H8S2 and molecular weight 120.01 g/mol. UNII OXW45UTR7B; ChEBI 6854; InChIKey XNZOTQPMYMCTBZ-UHFFFAOYSA-N. Boiling Point: 30.00 to 33.00 °C. @ 20.00 mm Hg; Boiling Point: 83-84 °C (170 mm Hg); 30-33 °C (20 mm Hg); Density: 0.927-0.933.

Source: PubChem / Wikidata; the batch COA governs where values differ.

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