Cas no 267666-54-6 (7,8-dimethoxy-5H-Pyrido[4,3-b]indole)

7,8-dimethoxy-5H-Pyrido[4,3-b]indole structure
267666-54-6 structure
Product Name:7,8-dimethoxy-5H-Pyrido[4,3-b]indole
CAS No:267666-54-6
MF:C13H12N2O2
MW:228.246582984924
CID:1110106
PubChem ID:10513540
Update Time:2025-04-20

7,8-dimethoxy-5H-Pyrido[4,3-b]indole Chemical and Physical Properties

Names and Identifiers

    • 7,8-dimethoxy-5H-Pyrido[4,3-b]indole
    • 267666-54-6
    • DB-350692
    • Inchi: 1S/C13H12N2O2/c1-16-12-5-8-9-7-14-4-3-10(9)15-11(8)6-13(12)17-2/h3-7,15H,1-2H3
    • InChI Key: MFLQQJZMBZCWSC-UHFFFAOYSA-N
    • SMILES: O(C)C1C(=CC2=C(C=1)C1C=NC=CC=1N2)OC

Computed Properties

  • Exact Mass: 228.089877630g/mol
  • Monoisotopic Mass: 228.089877630g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 2
  • Complexity: 274
  • 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: 2.3
  • Topological Polar Surface Area: 47.1?2
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