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Phenethyl isothiocyanate

CAS 2257-09-2C6H5CH2CH2NCSChemical Synthesis

Phenethyl isothiocyanate (CAS: 2257-09-2, Formula: C6H5CH2CH2NCS, MW: 163.24) is a notable organosulfur compound. It functions as a key intermediate in chemical synthesis and a bioactive molecule with significant roles in cancer research and cell biology. Its natural occurrence in plants like horseradish also points to its relevance in nutrition research and its classification as a phytochemical. This compound is supplied by TSS for research and development purposes.

IUPAC
2-Phenylethyl isothiocyanate
Synonyms
2-Phenylethyl isothiocyanate
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Phenethyl isothiocyanate (C6H5CH2CH2NCS) — chemical structure, CAS 2257-09-2; Chemistry, fine chemical supplied by Tech Serve Solutions
Anti-proliferative AgentsBioactive Small MoleculesBuilding BlocksCancer ResearchCell BiologyChemical SynthesisChemopreventive AgentsNutrition ResearchOrganic Building BlocksSulfur Compounds
01 /Applications

Chemical Synthesis

Phenethyl isothiocyanate serves as a versatile building block in organic synthesis, enabling the creation of more complex molecular structures.

Cancer Research

This compound is investigated for its anti-proliferative properties, making it a subject of interest in cancer research and chemopreventive studies.

Cell Biology Studies

As a bioactive small molecule, Phenethyl isothiocyanate is utilised in cell biology to understand cellular mechanisms and responses to specific chemical stimuli.

Phytochemical Research

Its presence in plants like horseradish positions it as a phytochemical for study in nutrition research and understanding plant-derived bioactivity.

02 /Properties
Molecular weight163.24
Linear formulaC6H5CH2CH2NCS
Assay99%
Boiling point139-140 °C/11 mmHg(lit.)
Density1.094 g/mL at 25 °C(lit.)
Refractive indexn20/D 1.5888(lit.)
Storage temperature2-8°C
03 /Safety & handling
GHS hazard pictogram: Harmful / irritant (GHS07)
Harmful / irritant
GHS hazard pictogram: Health hazard (GHS08)
Health hazard
Danger

Hazard statements

  • H302Harmful if swallowed
  • H312Harmful in contact with skin
  • H315Causes skin irritation
  • H317May cause an allergic skin reaction
  • H319Causes serious eye irritation
  • H332Harmful if inhaled
  • H334May cause allergy or asthma symptoms if inhaled
  • H335May cause respiratory irritation

Precautionary statements

  • P261Avoid breathing dust, fume, gas or vapours
  • P280Wear protective gloves, clothing and eye/face protection
  • P305IF IN EYES
  • P342
Protective equipmentEyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Flash point113 °C / 235.4 °F
Transport (UN / ADR)UN 2206 6.1/PG 3
Water hazard class (WGK, DE)3
Hazard codes (EU)Xn
Risk statements (R)20/21/22-36/37/38-42
Safety statements (S)23-26-36

Hazard information is provided for guidance. Always consult the product Safety Data Sheet (SDS), available on request, before handling.

04 /Identifiers & registry
CAS number
2257-09-2
MDL number
MFCD00004821
PubChem substance
24855324
Beilstein registry
2084162
05 /Additional specifications
Gene Informationhuman ... CYP1A2(1544)
Organolepticgreen
Allergenno known allergens
06 /Quality & supply

Documentation

Every batch ships with a Certificate of Analysis covering assay, identity and purity; the grade is confirmed against your enquiry. Safety Data Sheets and technical data sheets are available on request.

Supply & logistics

Samples for technical evaluation; bulk MOQ by grade and packaging. In-stock material ships in 7–10 working days, worldwide, with full export documentation.

07 /Frequently asked questions

What is Phenethyl isothiocyanate used for?

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Phenethyl isothiocyanate (CAS: 2257-09-2) is used as a building block in chemical synthesis, in cancer research for its anti-proliferative properties, in cell biology studies, and as a phytochemical in nutrition research.

What is the CAS number and chemical formula for Phenethyl isothiocyanate?

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The CAS number is 2257-09-2 and the chemical formula is C6H5CH2CH2NCS.

What grade and purity does Tech Serve Solutions supply for Phenethyl isothiocyanate?

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Tech Serve Solutions supplies Phenethyl isothiocyanate with an assay of 99%. We do not represent this product as USP, BP, or EP grade unless explicitly stated in the specifications.

What are the primary safety concerns when handling Phenethyl isothiocyanate?

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Phenethyl isothiocyanate is classified as Danger. It can be harmful if swallowed, inhaled, or in contact with skin, and may cause skin and eye irritation and respiratory irritation. It may also cause an allergic skin reaction. Appropriate personal protective equipment, including gloves, eye protection, and respiratory protection, is essential.

How is Phenethyl isothiocyanate packed, shipped, and exported by TSS?

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Phenethyl isothiocyanate is packed and shipped according to international regulations for hazardous materials. As a global supplier and exporter, TSS ensures compliance for all shipments.

How can I request a sample or quote for Phenethyl isothiocyanate?

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To request a sample or a quote for Phenethyl isothiocyanate, please contact the TSS sales department through our website or by phone.

Need Phenethyl isothiocyanate in a specific grade or volume?