Cas no 1391053-30-7 (3,5,6-Trichloro-8-quinolinecarboxylic Acid)

3,5,6-Trichloro-8-quinolinecarboxylic acid is a halogenated quinoline derivative with applications in organic synthesis and pharmaceutical intermediates. Its structure, featuring three chlorine substituents and a carboxylic acid group, enhances reactivity and selectivity in chemical transformations. The compound is valued for its utility in constructing complex heterocyclic frameworks, particularly in medicinal chemistry research. Its high purity and stability make it suitable for precise synthetic applications. The presence of multiple halogens also facilitates further functionalization, enabling diverse derivatization pathways. Proper handling is required due to its potential reactivity under certain conditions. This compound is typically supplied with analytical data to ensure consistency in research and industrial applications.
3,5,6-Trichloro-8-quinolinecarboxylic Acid structure
1391053-30-7 structure
Product Name:3,5,6-Trichloro-8-quinolinecarboxylic Acid
CAS No:1391053-30-7
MF:C10H4Cl3NO2
MW:276.503259658813
CID:1061457
PubChem ID:71752715
Update Time:2025-06-09

3,5,6-Trichloro-8-quinolinecarboxylic Acid Chemical and Physical Properties

Names and Identifiers

    • 3,5,6-Trichloro-8-quinolinecarboxylic Acid
    • 3,5,6-Trichloroquinoline-8-carboxylic Acid;
    • DB-261931
    • 3,5,6-Trichloroquinoline-8-carboxylic Acid
    • 1391053-30-7
    • Inchi： 1S/C10H4Cl3NO2/c11-4-1-5-8(13)7(12)2-6(10(15)16)9(5)14-3-4/h1-3H,(H,15,16)
    • InChI Key： HGMQKAMHFFQHQY-UHFFFAOYSA-N
    • SMILES： ClC1=C(C=C(C(=O)O)C2C1=CC(=CN=2)Cl)Cl

Computed Properties

  • Exact Mass: 274.930761g/mol
  • Monoisotopic Mass: 274.930761g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 1
  • Complexity: 289
  • 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
  • XLogP3: 3.6
  • Topological Polar Surface Area: 50.2?2

Experimental Properties

  • Density: 1.7±0.1 g/cm3
  • Melting Point: 232-234°C
  • Boiling Point: 440.7±40.0 °C at 760 mmHg
  • Flash Point: 220.3±27.3 °C
  • Solubility: Acetone (Slightly), DMSO (Slightly, Heated, Sonicated)
  • Vapor Pressure: 0.0±1.1 mmHg at 25°C

3,5,6-Trichloro-8-quinolinecarboxylic Acid Security Information

3,5,6-Trichloro-8-quinolinecarboxylic Acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
T774285-5mg
3,5,6-Trichloro-8-quinolinecarboxylic Acid
 1391053-30-7
5mg
 $ 184.00 2023-09-05
TRC
T774285-50mg
3,5,6-Trichloro-8-quinolinecarboxylic Acid
 1391053-30-7
50mg
 $ 1453.00 2023-09-05

3,5,6-Trichloro-8-quinolinecarboxylic Acid Related Literature

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