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3-Fluorobenzyl isocyanate

CAS 102422-56-0FC6H4CH2NCOChemical Synthesis

3-Fluorobenzyl isocyanate (CAS: 102422-56-0) is an organic compound with the formula FC6H4CH2NCO and a molecular weight of 151.14 g/mol. This fluorinated benzyl isocyanate serves as a valuable building block in organic synthesis. It is particularly useful for introducing the 3-fluorobenzyl group into various molecules, finding applications in the development of pharmaceuticals and agrochemicals.

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3-Fluorobenzyl isocyanate (FC6H4CH2NCO) — chemical structure, CAS 102422-56-0; Chemistry, fine chemical supplied by Tech Serve Solutions
Building BlocksC7-C8Chemical SynthesisFluorinated Building BlocksIsocyanatesNitrogen CompoundsOrganic Building Blocks
01 /Applications

Pharmaceutical Intermediate

3-Fluorobenzyl isocyanate is employed in the synthesis of complex organic molecules that may serve as active pharmaceutical ingredients (APIs) or their precursors. Its fluorinated aromatic structure can impart desirable pharmacokinetic properties.

Agrochemical Development

This compound can be utilised in the creation of novel agrochemicals, such as herbicides, insecticides, or fungicides. The incorporation of fluorine atoms can enhance biological activity and stability.

Material Science Research

As a reactive isocyanate, it may be investigated for its potential in polymer chemistry and material science, enabling the synthesis of specialised fluorinated polymers or functional materials.

Organic Synthesis Building Block

It acts as a versatile reagent for introducing the 3-fluorobenzyl moiety into diverse organic structures. Its reactivity allows for efficient functionalisation in multi-step synthetic routes.

02 /Properties
Molecular weight151.14
Linear formulaFC6H4CH2NCO
Assay98%
Boiling point209 °C(lit.)
Refractive indexn20/D 1.506(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
  • 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 point90 °C / 194 °F
Transport (UN / ADR)UN 3080 6.1/PG 2
Water hazard class (WGK, DE)3
Hazard codes (EU)Xn
Risk statements (R)20/21/22-36/37/38
Safety statements (S)26-36/37/39

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

04 /Identifiers & registry
CAS number
102422-56-0
MDL number
MFCD02093692
05 /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.

06 /Frequently asked questions

What is 3-Fluorobenzyl isocyanate used for?

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3-Fluorobenzyl isocyanate is primarily used as a building block in organic synthesis, particularly for the development of pharmaceuticals and agrochemicals, and in material science research.

What are the CAS number and formula for 3-Fluorobenzyl isocyanate?

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The CAS number is 102422-56-0 and the linear formula is FC6H4CH2NCO.

What grade and purity does Tech Serve Solutions supply?

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Tech Serve Solutions supplies 3-Fluorobenzyl isocyanate with an assay of 98%. We do not represent this product as USP, BP, or EP grade.

How should 3-Fluorobenzyl isocyanate be handled safely?

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Handle with appropriate personal protective equipment, including eyeshields, face shields, gloves, and a suitable respirator. It is harmful if swallowed, in contact with skin, or if inhaled, and causes skin and eye irritation and respiratory irritation. Consult the Safety Data Sheet for full details.

Is 3-Fluorobenzyl isocyanate available for export?

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Yes, Tech Serve Solutions is a global supplier and exporter of fine chemicals, including 3-Fluorobenzyl isocyanate.

How can I request a quote or sample for 3-Fluorobenzyl isocyanate?

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Please contact our sales team via the website or direct inquiry to request a quote or sample of 3-Fluorobenzyl isocyanate.

Need 3-Fluorobenzyl isocyanate in a specific grade or volume?