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Butyl isocyanatoacetate

CAS 17046-22-9OCNCH2CO2(CH2)3CH3Chemical Synthesis

Butyl isocyanatoacetate (CAS: 17046-22-9) is a reactive organic compound with the linear formula OCNCH2CO2(CH2)3CH3 and a molecular weight of 157.17 g/mol. As an isocyanate and ester, it serves as a versatile building block in organic synthesis. Its applications span chemical research and development, facilitating the creation of complex molecules. Tech Serve Solutions offers this compound for laboratory and industrial synthesis needs.

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Butyl isocyanatoacetate (OCNCH2CO2(CH2)3CH3) — chemical structure, CAS 17046-22-9; Chemistry, fine chemical supplied by Tech Serve Solutions
Building BlocksChemical SynthesisIsocyanatesNitrogen CompoundsOrganic Building Blocks
01 /Applications

Organic Synthesis Intermediate

Butyl isocyanatoacetate functions as a valuable intermediate in the synthesis of diverse organic compounds. Its reactive isocyanate group allows for facile derivatization through addition reactions with nucleophiles.

Building Block for Heterocycles

The compound can be employed in the construction of heterocyclic ring systems, which are prevalent in pharmaceuticals and agrochemicals. Its ester functionality offers further synthetic possibilities.

Reagent in Chemical Research

Researchers utilise Butyl isocyanatoacetate in exploratory synthesis and methodology development. It enables access to novel chemical structures and functional group transformations.

02 /Properties
Molecular weight157.17
Linear formulaOCNCH2CO2(CH2)3CH3
Assay98%
Boiling point213 °C(lit.)
Density1.06 g/mL at 25 °C(lit.)
Refractive indexn20/D 1.43(lit.)
Storage temperature2-8°C
03 /Safety & handling
GHS hazard pictogram: Harmful / irritant (GHS07)
Harmful / irritant
Warning

Hazard statements

  • H302Harmful if swallowed
  • H312Harmful in contact with skin
  • H315Causes skin irritation
  • H319Causes serious eye irritation
  • H332Harmful 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
Protective equipmentEyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Flash point99 °C / 210.2 °F
Transport (UN / ADR)UN 1693 6.1 / PGII
Water hazard class (WGK, DE)3
Hazard codes (EU)Xn
Risk statements (R)20/21/22-36/37/38
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
17046-22-9
MDL number
MFCD00041743
PubChem substance
24871853
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 Butyl isocyanatoacetate used for?

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Butyl isocyanatoacetate is used as an intermediate and building block in organic synthesis and chemical research.

What are the CAS number and formula for Butyl isocyanatoacetate?

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The CAS number is 17046-22-9, and the linear formula is OCNCH2CO2(CH2)3CH3.

What grade and purity does Tech Serve Solutions supply?

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Tech Serve Solutions supplies Butyl isocyanatoacetate with a minimum assay of 98%. This is a technical/research grade, and TSS does not represent it as USP, BP, or EP grade.

How should Butyl isocyanatoacetate be handled safely?

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Butyl isocyanatoacetate is harmful if swallowed, in contact with skin, or if inhaled, and causes skin and serious eye irritation. It may also cause respiratory irritation. Handle with appropriate personal protective equipment, including gloves, eyeshields, and respiratory protection, in a well-ventilated area.

Is Butyl isocyanatoacetate a controlled substance?

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The provided data does not indicate that Butyl isocyanatoacetate is a controlled substance.

How is Butyl isocyanatoacetate packed, shipped, and exported?

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TSS packs and ships Butyl isocyanatoacetate according to international regulations for hazardous materials, including UN 1693, Class 6.1, Packing Group II. As a global supplier, TSS exports this chemical worldwide.

How can I request a sample or quote for Butyl isocyanatoacetate?

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To request a sample or a quote for Butyl isocyanatoacetate, please contact the TSS sales department via our website or by phone.

Need Butyl isocyanatoacetate in a specific grade or volume?