Cas no 102878-84-2 (Quinoline-5-sulfonyl chloride)

Quinoline-5-sulfonyl chloride structure
Quinoline-5-sulfonyl chloride structure
Product Name:Quinoline-5-sulfonyl chloride
CAS No:102878-84-2
MF:C9H6ClNO2S
MW:227.667439937592
MDL:MFCD09733990
CID:824120
PubChem ID:16787232
Update Time:2025-04-19

Quinoline-5-sulfonyl chloride Chemical and Physical Properties

Names and Identifiers

    • Quinoline-5-sulfonyl chloride
    • 5-Quinolinesulfonyl chloride
    • Quinoline-5-sulfonyl
    • IGBMUOLGIDEIJH-UHFFFAOYSA-N
    • 5-Quinolinesulfonyl Chloride;
    • MFCD09733990
    • BS-13933
    • 102878-84-2
    • SY184782
    • DB-333135
    • EN300-61825
    • quinoline-5-sulfonylchloride
    • J-000828
    • DTXSID00588494
    • AKOS009145545
    • SCHEMBL4325354
    • MDL： MFCD09733990
    • Inchi： 1S/C9H6ClNO2S/c10-14(12,13)9-5-1-4-8-7(9)3-2-6-11-8/h1-6H
    • InChI Key： IGBMUOLGIDEIJH-UHFFFAOYSA-N
    • SMILES： ClS(C1=CC=CC2C1=CC=CN=2)(=O)=O

Computed Properties

  • Exact Mass: 226.98100
  • Monoisotopic Mass: 226.9807773g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 298
  • 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: 2.6
  • Topological Polar Surface Area: 55.4?2

Experimental Properties

  • Density: 1.483±0.06 g/cm3 (20 oC 760 Torr),
  • Melting Point: 91-95 oC
  • Solubility: Slightly soluble (1.2 g/l) (25 o C),
  • PSA: 55.41000
  • LogP: 3.24310

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