Cas no 155602-27-0 (2,5-Quinolinedicarboxylicacid)

2,5-Quinolinedicarboxylicacid structure
2,5-Quinolinedicarboxylicacid structure
Product Name:2,5-Quinolinedicarboxylicacid
CAS No:155602-27-0
MF:C11H7NO4
MW:217.177582979202
CID:107062
PubChem ID:10013581
Update Time:2025-04-18

2,5-Quinolinedicarboxylicacid Chemical and Physical Properties

Names and Identifiers

    • 2,5-Quinolinedicarboxylicacid
    • quinoline-2,5-dicarboxylic acid
    • 2,5-Quinolinedicarboxylicacid(9CI)
    • 2,5-quinolinedicarboxylic acid
    • DTXSID30434172
    • SCHEMBL2806839
    • 155602-27-0
    • Inchi: 1S/C11H7NO4/c13-10(14)7-2-1-3-8-6(7)4-5-9(12-8)11(15)16/h1-5H,(H,13,14)(H,15,16)
    • InChI Key: QQPOMDFNWUIUJL-UHFFFAOYSA-N
    • SMILES: OC(C1=CC=CC2C1=CC=C(C(=O)O)N=2)=O

Computed Properties

  • Exact Mass: 217.03751
  • Monoisotopic Mass: 217.03750770g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 304
  • 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: 1.6
  • Topological Polar Surface Area: 87.5?2

Experimental Properties

  • PSA: 87.49
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