Cas no 1353087-61-2 (2,6-Dichloro-5-iodonicotinonitrile)

2,6-Dichloro-5-iodonicotinonitrile is a halogenated nicotinonitrile derivative with significant utility in synthetic organic chemistry, particularly in the preparation of heterocyclic compounds. Its distinct structure, featuring chlorine and iodine substituents on the pyridine ring, enhances its reactivity in cross-coupling and nucleophilic substitution reactions. This compound serves as a versatile intermediate in pharmaceutical and agrochemical research, enabling the synthesis of complex molecules with potential biological activity. The presence of both electron-withdrawing groups (chloro and cyano) and a heavy halogen (iodo) facilitates selective functionalization, making it valuable for constructing tailored molecular frameworks. High purity and stability under standard conditions further support its use in precision synthesis.
2,6-Dichloro-5-iodonicotinonitrile structure
1353087-61-2 structure
Product Name:2,6-Dichloro-5-iodonicotinonitrile
CAS No:1353087-61-2
MF:C6HCl2IN2
MW:298.89601111412
CID:3045251
PubChem ID:84819937
Update Time:2025-05-28

2,6-Dichloro-5-iodonicotinonitrile Chemical and Physical Properties

Names and Identifiers

    • 2,6-Dichloro-5-iodonicotinonitrile
    • XYWZESOQBNMGLL-UHFFFAOYSA-N
    • FCH2572309
    • AK156240
    • AX8290561
    • 2,6-DICHLORO-5-IODOPYRIDINE-3-CARBONITRILE
    • DB-148982
    • SCHEMBL564692
    • C6HCl2IN2
    • AKOS024261581
    • CS-0060110
    • 1353087-61-2
    • DS-8764
    • 2,6-Dichloro-5-iodo-3-pyridinecarbonitrile
    • Inchi: 1S/C6HCl2IN2/c7-5-3(2-10)1-4(9)6(8)11-5/h1H
    • InChI Key: XYWZESOQBNMGLL-UHFFFAOYSA-N
    • SMILES: IC1=C(N=C(C(C#N)=C1)Cl)Cl

Computed Properties

  • Exact Mass: 297.85615g/mol
  • Monoisotopic Mass: 297.85615g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 190
  • 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: 36.7
  • XLogP3: 3.1

2,6-Dichloro-5-iodonicotinonitrile Security Information

  • Signal Word:Warning
  • Hazard Statement: H302
  • Warning Statement: P280-P305+P351+P338
  • Storage Condition:Keep in dark place,Inert atmosphere,Room temperature

2,6-Dichloro-5-iodonicotinonitrile Pricemore >>

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