Cas no 72359-40-1 (Quinoline, 3,5,8-trimethyl-)

Quinoline, 3,5,8-trimethyl- structure
Quinoline, 3,5,8-trimethyl- structure
Product Name:Quinoline, 3,5,8-trimethyl-
CAS No:72359-40-1
MF:C12H13N
MW:171.238322973251
CID:544103
PubChem ID:12494814
Update Time:2025-04-19

Quinoline, 3,5,8-trimethyl- Chemical and Physical Properties

Names and Identifiers

    • Quinoline, 3,5,8-trimethyl-
    • 3,5,8-trimethylquinoline
    • SCHEMBL20928236
    • DTXSID00500333
    • 72359-40-1
    • Inchi： 1S/C12H13N/c1-8-6-11-9(2)4-5-10(3)12(11)13-7-8/h4-7H,1-3H3
    • InChI Key： FDNNOBWDHUFSPM-UHFFFAOYSA-N
    • SMILES： N1C=C(C)C=C2C(C)=CC=C(C)C=12

Computed Properties

  • Exact Mass: 171.10489
  • Monoisotopic Mass: 171.104799419g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 0
  • Complexity: 178
  • 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: 3.3
  • Topological Polar Surface Area: 12.9?2

Experimental Properties

  • PSA: 12.89

Quinoline, 3,5,8-trimethyl- Related Literature

72359-40-1 (Quinoline, 3,5,8-trimethyl-) Related Products

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