Tert-Butyl Isocyanate | 1609-86-5

Cas No :

1609-86-5

Form :

Liquid

Molecular Weight :

99.13

Molecular Formula :

C5H9NO

Boiling Point :

85 °C

Flash Point :

-4 °C

Solubility :

Chloroform (Soluble), Dmso (Slightly)

Description :

Overview of Tert-Butyl Isocyanate

 

Tert-Butyl Isocyanate is a reactive isocyanate compound used in pharmaceutical synthesis, polymer chemistry, and as a derivatizing agent in analytical chemistry. Known for its bulky tert-butyl group providing steric effects, high reactivity with nucleophiles, and use in protecting group chemistry, Tert-Butyl Isocyanate is widely used in pharmaceutical manufacturing, producing carbamates, and specialty chemical synthesis.

This compound appears as a colorless liquid with a characteristic pungent odor. Its isocyanate functionality, combined with the bulky tert-butyl group, provides unique reactivity patterns.

Related products include Phenyl Isocyanate, Methyl Isocyanate, and other isocyanates used in pharmaceutical synthesis and polymer chemistry.

 

 

Applications of Tert-Butyl Isocyanate

 

Pharmaceutical Synthesis

 

  • It is used to introduce tert-butyl carbamate (Boc) to protect certain groups
  • Utilized for pharmaceutical intermediate synthesis
  • It is used in the preparation of drugs for drug testing
  • Used in the synthesis of peptides as well as protection

 

Analytical Chemistry

 

  • It is used as a desivatizing agent for the GC-MS analysis
  • Utilized for amino acid analysis
  • Used in preparing volatile derivatives
  • Used in the creation of analytic methods

 

Industrial Chemical Synthesis

 

  • Used in producing specialty chemicals
  • Applied in synthesizing polymer additives
  • Used in manufacturing agrochemical intermediates
  • Applied in developing performance chemicals

 

 

Safety & Handling Guidelines

  • HIGHLY TOXIC—fatal if inhaled
  • FLAMMABLE LIQUID—keep away from ignition sources
  • MOISTURE SENSITIVE—reacts with water, releasing CO₂
  • Use only in a well-ventilated fume hood
  • Wear appropriate PPE, including a respirator, gloves, and a face shield
  • Handle under anhydrous conditions
  • Store in tightly sealed containers under inert gas

 

 

Where to Buy Tert-Butyl Isocyanate?

 

Tert-Butyl Isocyanate Manufacturer

 

ChemicalBull supplies high-purity Tert-Butyl Isocyanate for pharmaceutical and research applications.

 

Tert-Butyl Isocyanate Supplier & Distributor

 

  • Available in controlled quantities for authorized use
  • High-purity anhydrous grade (98%, 99%)
  • Special moisture-resistant packaging under inert gas
  • COA, MSDS, and comprehensive safety documentation provided

 

 

MSDS

 

Includes comprehensive toxicity warnings, reactivity information, and emergency procedures.

 

 

Frequently Asked Questions (FAQs)

 

  1. What is Tert-Butyl Isocyanate used for?

    Used in introducing Boc protecting groups, pharmaceutical synthesis, GC-MS derivatization, and producing carbamates.

  2. What is the molecular formula?

    Molecular formula: C₅H₉NO with molecular weight 99.13 g/mol.

  3. What is the structure?

    Isocyanate group attached to tert-butyl: (CH₃)₃C-N=C=O.