Cas no 153915-05-0 (1H-Benzotriazole,6-(chloromethyl)-)

1H-Benzotriazole,6-(chloromethyl)- is a chloromethyl-substituted benzotriazole derivative, primarily utilized as an intermediate in organic synthesis and specialty chemical applications. Its reactive chloromethyl group enables facile functionalization, making it valuable for the preparation of more complex heterocyclic compounds, corrosion inhibitors, and polymer additives. The benzotriazole core contributes to UV absorption and metal-chelating properties, enhancing its utility in coatings and stabilizers. This compound is particularly noted for its stability and compatibility with a range of industrial processes. Careful handling is advised due to its reactivity, but its versatility makes it a useful building block in pharmaceuticals, agrochemicals, and material science research.
1H-Benzotriazole,6-(chloromethyl)- structure
153915-05-0 structure
Product Name:1H-Benzotriazole,6-(chloromethyl)-
CAS No:153915-05-0
MF:C7H6ClN3
MW:167.595639705658
CID:106387
PubChem ID:6411428
Update Time:2025-06-07

1H-Benzotriazole,6-(chloromethyl)- Chemical and Physical Properties

Names and Identifiers

    • 1H-Benzotriazole,6-(chloromethyl)-
    • 1-H-Benzotriazole,5-(chloromethyl)-(9CI)
    • 5-(Chloromethyl)-1H-benzotriazole
    • 1H-Benzotriazole,5-(chloromethyl)-(9CI)
    • LEWWLWBQKZETKB-UHFFFAOYSA-N
    • AKOS006382440
    • 5-(chloromethyl)-2H-benzotriazole
    • 5-(chloromethyl)-1H-benzo[d][1,2,3]triazole
    • 5-chloromethyl-1H-1,2,3-benzotriazole
    • 5-chloromethyl-1,2,3-benzotriazole
    • SCHEMBL7127295
    • 153915-05-0
    • EN300-6206237
    • 5-(CHLOROMETHYL)-1H-1,2,3-BENZOTRIAZOLE
    • SCHEMBL24214987
    • Inchi: 1S/C7H6ClN3/c8-4-5-1-2-6-7(3-5)10-11-9-6/h1-3H,4H2,(H,9,10,11)
    • InChI Key: LEWWLWBQKZETKB-UHFFFAOYSA-N
    • SMILES: ClCC1C=CC2C(C=1)=NNN=2

Computed Properties

  • Exact Mass: 167.025
  • Monoisotopic Mass: 167.025
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 142
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 41.6A^2
  • XLogP3: 1.4

1H-Benzotriazole,6-(chloromethyl)- Pricemore >>

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