Allicin

Name: Allicin
Brand: Zemixal
SKU: ZX-027925

Reference StandardAvailable on request

Buy Allicin (CAS 539-86-6) from Zemixal: C6H10OS2, COA and SDS with every lot, worldwide shipping. Catalogue no. ZX-027925.

Pack sizes

CAS number539-86-6

FormulaC₆H₁₀OS₂

Molar mass162.3 g/mol

Physical formSolid

HS code38229090

InChIKeyJDLKFOPOAOFWQN-UHFFFAOYSA-N

IUPAC name3-prop-2-enylsulfinylsulfanylprop-1-ene

About Allicin

Allicin is supplied by Zemixal as a characterised reference material for Allicin analysis. Identity at a glance (Reference Standard): CAS 539-86-6, formula C6H10OS2 and molar mass 162.3 g/mol. It is handled as a solid.

Where it is used

Identification & assay
Method development & validation
QC reference material
Fine chemical synthesis

Handling and storage

Classified under GHS with signal word Warning and hazard statements H315, H319 and H335. Read the SDS before first use.

Standard pack sizes are 10 mg, 25 mg, 50 mg and 100 mg, and custom quantities are quoted on request. Each lot travels with a certificate of analysis with characterisation data. Send an enquiry through the quote panel and you get a formal offer with Incoterms and delivery time.

Reference standards for Allicin

See every impurity, metabolite and related compound we list for this API.

Allicin standards

Typical uses

Identification & assay
Method development & validation
QC reference material
Fine chemical synthesis

Applications

Pharmaceutical Manufacturing and QC Research Labs and Universities

Specifications and identifiers

Specifications of Allicin
Product name	Allicin
Catalogue number	ZX-027925
CAS number	539-86-6
IUPAC name	3-prop-2-enylsulfinylsulfanylprop-1-ene
Molecular formula	C₆H₁₀OS₂
Molar mass	162.3 g/mol
Exact mass	162.0173
Grade	Reference Standard
Physical form	Solid
XLogP3	1.3
H-bond donors / acceptors	0 / 3
Topological polar surface area	61.6 Å²
HS code	38229090
InChIKey	JDLKFOPOAOFWQN-UHFFFAOYSA-N
SMILES	C=CCSS(=O)CC=C
PubChem CID	65036
Synonyms	S-Allyl prop-2-ene-1-sulfinothioate, Diallyl Thiosulfinate, Thio-2-propene-1-sulfinic acid S-allyl ester, Allylthiosulphinic acid allyl ester, 2-Propene-1-sulfinothioic acid S-2-propenyl ester, 3-[(prop-2-ene-1-sulfinyl)sulfanyl]prop-1-ene, 3-((prop-2-ene-1-sulfinyl)sulfanyl)prop-1-ene, Diallyldisulfid-S-oxid, 2-Propene-1-sulfinothioic acid, S-2-propenyl ester, S-Allyl acrylo-1-sulphinothioate, S-allyl 2-propene-1-sulfinothioate

Lot values are stated on the batch certificate of analysis. Ask for a typical COA with your quotation.

Safety and GHS hazards

Irritant or harmful

Signal word Warning

H315Causes skin irritation
H319Causes serious eye irritation
H335May cause respiratory irritation

Precautionary statements P261, P264, P264 + P265, P271, P280, P302 + P352, P304 + P340, P305 + P351 + P338, P319, P321, P332 + P317, P337 + P317, P362 + P364, P403 + P233, P405, P501

Classification summarised from public GHS notifications. It can vary with grade and concentration, so always follow the SDS supplied with your lot.

Pack sizes

Pack sizes of Allicin
10 mg	Quoted on request
25 mg	Quoted on request
50 mg	Quoted on request
100 mg	Quoted on request

Need a different size? Bulk drums and custom packing are quoted on request through the quote form on this page.

Questions about Allicin

Which CAS number identifies Allicin?

Allicin is registered under CAS 539-86-6. You may also see it listed as S-Allyl prop-2-ene-1-sulfinothioate, Diallyl Thiosulfinate, Thio-2-propene-1-sulfinic acid S-allyl ester. Our catalogue number for this item is ZX-027925.

What are the formula and molar mass of Allicin?

For Allicin, its formula is C6H10OS2 and its molar mass is 162.3 g/mol. The systematic (IUPAC) name is 3-prop-2-enylsulfinylsulfanylprop-1-ene. InChIKey JDLKFOPOAOFWQN-UHFFFAOYSA-N lets you match it in any structure database.

How is Allicin used in pharmaceutical QC?

Allicin is a characterised reference material linked to Allicin. Laboratories use it to identify and quantify this impurity during method development and validation, stability work, batch release testing and regulatory submissions.

What grade and pack sizes are available for Allicin?

This listing is Reference Standard grade. Standard packs are 10 mg, 25 mg, 50 mg, 100 mg. Larger quantities and custom packing can be quoted on request.

Which documents come with Allicin?

Each lot ships with a batch certificate of analysis and a 16-section GHS safety data sheet. A typical COA or specification sheet can be shared with the quotation before you order.

Can Zemixal ship Allicin to my country?

Yes. Because Allicin is classed as hazardous, it travels in UN-approved packaging as dangerous goods under IATA or IMDG rules, with the export paperwork your broker needs.

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