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API Process Intermediates & Related Compounds

4-Isothiocyanato-2-(trifluoromethyl)benzonitrile

Reference StandardIn stock

Buy 4-Isothiocyanato-2-(trifluoromethyl)benzonitrile (CAS 143782-23-4) from Zemixal. Lab and bulk packs, batch COA, fast global delivery.

Pack sizes
4-Isothiocyanato-2-(trifluoromethyl)benzonitrile chemical structure
CAS number143782-23-4
FormulaC9H3F3N2S
Molar mass228.2 g/mol
Physical formSolid
HS code2933
InChIKeyTYXKOMAQTWRDCR-UHFFFAOYSA-N
IUPAC name4-isothiocyanato-2-(trifluoromethyl)benzonitrile

About 4-Isothiocyanato-2-(trifluoromethyl)benzonitrile

Researchers and plant chemists source 4-Isothiocyanato-2-(trifluoromethyl)benzonitrile from Zemixal for routine and specialised work. For your records (Reference Standard), the material is defined by CAS 143782-23-4, formula C9H3F3N2S and molar mass 228.2 g/mol. It is handled as a solid.

Typical applications

  • API route development
  • Impurity fate & purge studies
  • Analytical method development

Storage and safety notes

Classified under GHS with signal word Danger and hazard statements H302+H312+H332, H302, H312 and H315. Read the SDS before first use.

Available as 10 mg, 25 mg, 50 mg, 100 mg and 250 mg. Larger or split packs can be arranged. You receive a batch certificate of analysis and a 16-section SDS with each order. Request pricing online and we confirm availability, documentation and freight to your country.

Reference standards for Enzalutamide

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

Enzalutamide standards

Typical uses

  • API route development
  • Impurity fate & purge studies
  • Analytical method development

Applications

Pharmaceutical Manufacturing and QCResearch Labs and Universities

Specifications and identifiers

Specifications of 4-Isothiocyanato-2-(trifluoromethyl)benzonitrile
Product name4-Isothiocyanato-2-(trifluoromethyl)benzonitrile
Catalogue numberZX-012171
CAS number143782-23-4
IUPAC name4-isothiocyanato-2-(trifluoromethyl)benzonitrile
Molecular formulaC9H3F3N2S
Molar mass228.2 g/mol
Exact mass227.9969
GradeReference Standard
Physical formSolid
XLogP33.9
H-bond donors / acceptors0 / 6
Topological polar surface area68.2 Ų
HS code2933
InChIKeyTYXKOMAQTWRDCR-UHFFFAOYSA-N
SMILESC1=CC(=C(C=C1N=C=S)C(F)(F)F)C#N
PubChem CID11615540
Synonyms4-Cyano-3-trifluoromethylphenylisothiocyanate, 4-Isothiocyanato-2-trifluoromethylbenzonitrile, 4-Thioisocyanato-2-(trifluoromethyl)benzonitrile, Benzonitrile, 4-isothiocyanato-2-(trifluoromethyl)-, 4-cyano-3-(trifluoromethyl)phenyl isothiocyanate, 4-cyano-3-(trifluoromethyl)phenylisothiocyanate, Enzalutamide ITS-1, CS-M0346, 4-isothiocyanato-2-trifluoromethyl benzonitrile, 4-Isothiocyanato-2-trifluoromethyl-benzonitrile, 2-(trifluoromethyl)-4-isothiocyanatobenzonitrile

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
GHS08 Health hazard
Health hazard
GHS09 Hazardous to the environment
Hazardous to the environment

Signal word Danger

  • H302+H312+H332Harmful if swallowed, in contact with skin or if inhaled
  • 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 or breathing difficulties if inhaled
  • H335May cause respiratory irritation
  • H341Suspected of causing genetic defects
  • H400Very toxic to aquatic life
  • H410Very toxic to aquatic life with long lasting effects

Precautionary statements P203, P233, P260, P261, P264, P264 + P265, P270, P271, P272, P273, P280, P284, P301 + P317, P302 + P352, P304 + P340, P305 + P351 + P338, P317, P318, P319, P321, P330, P332 + P317, P333 + P317, P337 + P317

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 4-Isothiocyanato-2-(trifluoromethyl)benzonitrile
10 mgQuoted on request
25 mgQuoted on request
50 mgQuoted on request
100 mgQuoted on request
250 mgQuoted on request

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

Questions about 4-Isothiocyanato-2-(trifluoromethyl)benzonitrile

Which CAS number identifies 4-Isothiocyanato-2-(trifluoromethyl)benzonitrile?
4-Isothiocyanato-2-(trifluoromethyl)benzonitrile is registered under CAS 143782-23-4. You may also see it listed as 4-Cyano-3-trifluoromethylphenylisothiocyanate, 4-Isothiocyanato-2-trifluoromethylbenzonitrile, 4-Thioisocyanato-2-(trifluoromethyl)benzonitrile. Our catalogue number for this item is ZX-012171.
What are the formula and molar mass of 4-Isothiocyanato-2-(trifluoromethyl)benzonitrile?
For 4-Isothiocyanato-2-(trifluoromethyl)benzonitrile, its formula is C9H3F3N2S and its molar mass is 228.2 g/mol. The systematic (IUPAC) name is 4-isothiocyanato-2-(trifluoromethyl)benzonitrile. InChIKey TYXKOMAQTWRDCR-UHFFFAOYSA-N lets you match it in any structure database.
How is 4-Isothiocyanato-2-(trifluoromethyl)benzonitrile used in pharmaceutical QC?
4-Isothiocyanato-2-(trifluoromethyl)benzonitrile is a characterised reference material linked to Enzalutamide. 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 4-Isothiocyanato-2-(trifluoromethyl)benzonitrile?
This listing is Reference Standard grade. Standard packs are 10 mg, 25 mg, 50 mg, 100 mg, 250 mg. Larger quantities and custom packing can be quoted on request.
Which documents come with 4-Isothiocyanato-2-(trifluoromethyl)benzonitrile?
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 4-Isothiocyanato-2-(trifluoromethyl)benzonitrile to my country?
Yes. Because 4-Isothiocyanato-2-(trifluoromethyl)benzonitrile 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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