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Sulfur Compounds (Thiols, Sulfides, Sulfonates)

Sulforaphen

Available on request

Buy Sulforaphen (CAS 592-95-0) from Zemixal. Request a quote with price, lead time and documents. Catalogue no. ZX-041438.

Pack sizes
Sulforaphen chemical structure
CAS number592-95-0
FormulaC6H9NOS2
Molar mass175.3 g/mol
InChIKeyQKGJFQMGPDVOQE-HWKANZROSA-N
IUPAC name(E)-4-isothiocyanato-1-methylsulfinylbut-1-ene

About Sulforaphen

Sulforaphen sits in our sulfur Compounds (Thiols, Sulfides, Sulfonates) section and ships worldwide from stock or short lead time. Key data: CAS 592-95-0, formula C6H9NOS2 and molar mass 175.3 g/mol.

Typical applications

  • Organic synthesis
  • API synthesis

Handling and storage

Classified under GHS with signal word Warning and hazard statements H302. Read the SDS before first use.

Available as 100 mg, 250 mg, 1 g and 5 g. Larger or split packs can be arranged. Every shipment includes a batch certificate of analysis and a 16-section SDS. Add it to your quote list and our team replies with price, lead time and shipping options within one business day.

Typical uses

  • Organic synthesis
  • API synthesis

Applications

Pharmaceutical Manufacturing and QCResearch Labs and Universities

Specifications and identifiers

Specifications of Sulforaphen
Product nameSulforaphen
Catalogue numberZX-041438
CAS number592-95-0
IUPAC name(E)-4-isothiocyanato-1-methylsulfinylbut-1-ene
Molecular formulaC6H9NOS2
Molar mass175.3 g/mol
Exact mass175.0126
XLogP31.5
H-bond donors / acceptors0 / 4
Topological polar surface area80.7 Ų
InChIKeyQKGJFQMGPDVOQE-HWKANZROSA-N
SMILESCS(=O)/C=C/CCN=C=S
PubChem CID6433206
SynonymsSulforaphene, Raphanin, 4-Isothiocyanato-1-(methylsulfinyl)-1-butene, 1-Butene, 4-isothiocyanato-1-(methylsulfinyl)-, 4-methylsulfinyl-3-butenyl isothiocyanate, 1-Butene, 4-isothiocyanato-1-(methylsulfinyl)-(9CI), 1-Butene, 4-isothiocyanato-1-(methylsulfinyl)-, [R-(E)]-, sulphoraphene, S-Sulforaphene, (R)-(E)-Sulforaphene, (1E)-4-isothiocyanato-1-methanesulfinylbut-1-ene, 1-Methylsulfinylbutenyl isothiocyante

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

Safety and GHS hazards

GHS07 Irritant or harmful
Irritant or harmful

Signal word Warning

  • H302Harmful if swallowed

Precautionary statements P264, P270, P301 + P317, P330, 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 Sulforaphen
100 mgQuoted on request
250 mgQuoted on request
1 gQuoted on request
5 gQuoted on request

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

Questions about Sulforaphen

Which CAS number identifies Sulforaphen?
Sulforaphen is registered under CAS 592-95-0. You may also see it listed as Sulforaphene, Raphanin, 4-Isothiocyanato-1-(methylsulfinyl)-1-butene. Our catalogue number for this item is ZX-041438.
What are the formula and molar mass of Sulforaphen?
For Sulforaphen, its formula is C6H9NOS2 and its molar mass is 175.3 g/mol. The systematic (IUPAC) name is (E)-4-isothiocyanato-1-methylsulfinylbut-1-ene. InChIKey QKGJFQMGPDVOQE-HWKANZROSA-N lets you match it in any structure database.
What grade and pack sizes are available for Sulforaphen?
The grade and assay are confirmed on the quotation and the batch COA. Standard packs are 100 mg, 250 mg, 1 g, 5 g. Larger quantities and custom packing can be quoted on request.
Which documents come with Sulforaphen?
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 Sulforaphen to my country?
Yes. Because Sulforaphen 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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