Methyl 4-isocyanatobenzoate

For research use only. Not for therapeutic Use.

  • CAT Number: L006867
  • CAS Number: 23138-53-6
  • Molecular Formula: C9H7NO3
  • Molecular Weight: 177.16
  • Purity: ≥95%
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Methyl 4-isocyanatobenzoate(Cat No.:L006867), is a chemical compound utilized in organic synthesis and materials science. Its molecular structure includes an isocyanate group attached to a benzoate ester. This compound is valuable in the production of polymers, adhesives, and coatings, where its reactivity enables the creation of cross-linked networks. Chemists use it as a reactive intermediate in the preparation of various organic derivatives, including pharmaceuticals and specialty chemicals. Its isocyanate functionality provides opportunities for diverse chemical transformations, making it a key building block in the synthesis of complex molecules.


CAS Number 23138-53-6
Molecular Formula C9H7NO3
Purity ≥95%
Storage 2-8°C
IUPAC Name methyl 4-isocyanatobenzoate
InChI InChI=1S/C9H7NO3/c1-13-9(12)7-2-4-8(5-3-7)10-6-11/h2-5H,1H3
InChIKey FQDDBYGPHUUTRN-UHFFFAOYSA-N
SMILES COC(=O)C1=CC=C(C=C1)N=C=O

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