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CAS 123-61-5

1,3-Phenylene Diisocyanate TCI P1092

1,3-Phenylene Diisocyanate TCI P1092

Chemical Identity

CAS No.
123-61-5
PubChem
CID 31262·SID 87575199
Formula
C8H4N2O2
Molecular weight
160.13 g/mol
Purity
>98.0%(GC)
Reference databases
ChemSpider·ECHA·Wikipedia
Full identifiers (IUPAC, SMILES, InChIKey)
IUPAC
1,3-diisocyanatobenzene
SMILES
C1=CC(=CC(=C1)N=C=O)N=C=O
InChIKey
VGHSXKTVMPXHNG-UHFFFAOYSA-N
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1,3-Phenylene Diisocyanate from TCI, also known as m-phenylene diisocyanate, is an aromatic compound that carries two isocyanate groups (–N=C=O) at the meta positions of a benzene ring. It belongs to the monomer group within polymer and macromolecule reagents. In the laboratory, it is used to prepare polyurethanes and polyureas through reaction with diols or diamines. It also serves as a crosslinking agent that links polymer chains together. Because each molecule has two reactive groups, it can join two other molecules at the same time.

Researchers choose 1,3-Phenylene Diisocyanate because its aromatic isocyanate groups react strongly with nucleophiles such as alcohols, amines, and water, so polymerization can proceed efficiently. The meta geometry on the ring gives polymer chains a bent shape. Compared with the para isomer, this shape changes the crystallinity, stiffness, and thermal behavior of the final material. The molecule is also small and structurally simple. That makes it a good model monomer for studying how polymer structure relates to properties, and a useful reagent for modifying material surfaces that carry hydroxyl or amine groups.

In Indonesia, this material is relevant to university and research laboratories that work in polymer chemistry, materials science, and coatings or adhesives development. Research groups can use it to synthesize polyurethane and polyurea samples, test how monomer geometry affects material properties, and prepare crosslinked networks for thesis and applied research projects. Industrial R&D laboratories can also use it for formulation studies and surface modification experiments, where a well-defined aromatic diisocyanate from an established brand such as TCI keeps results consistent.

TCI brochures (PDF)

  • Polyurethane synthesis: the two aromatic isocyanate groups react efficiently with diols, so the compound works as a reactive monomer for building polyurethane chains in controlled laboratory polymerizations.
  • Polyurea preparation: its high reactivity toward amines lets researchers form polyurea linkages with diamines, which makes it practical for synthesizing and comparing polyurea materials at research scale.
  • Polymer crosslinking: because each molecule has two reactive isocyanate groups, it can join two polymer chains at once, which makes it an effective crosslinker for building network structures.
  • Structure–property studies: its small, simple structure and bent meta geometry make it a useful model monomer for studying how chain shape affects crystallinity, stiffness, and thermal behavior compared with the para isomer.
  • Surface modification: the isocyanate groups react readily with hydroxyl and amine groups, so the compound can be used to functionalize or modify material surfaces that carry these reactive sites.

Brand TCI (product code P1092)
CAS number 123-61-5
Molecular formula —
Purity —
Category Materials Science > Polymer/Macromolecule Reagents > Monomers
Pack sizes check the product listing for available TCI pack sizes
Physical form see the TCI product specification and certificate of analysis
Storage keep tightly sealed and protected from moisture, following TCI's label recommendations

Isocyanate groups react with water, so store 1,3-Phenylene Diisocyanate in its original, tightly closed container and protect it from moisture and humid air. Keep the container in a cool, dry, well-ventilated area, away from alcohols, amines, and other nucleophilic substances it can react with. Follow the storage conditions on the TCI label and safety data sheet. Handle the compound in a fume hood and wear suitable gloves, safety glasses, and a lab coat. Avoid inhaling dust or vapors and avoid contact with skin and eyes, because isocyanates are known respiratory and skin sensitizers. Reseal the container promptly after each use, and dispose of waste according to local laboratory chemical waste regulations.

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