Cas no 591244-01-8 (5-Chloro-2-methoxy-8-(methoxymethyl)quinoline)

5-Chloro-2-methoxy-8-(methoxymethyl)quinoline structure
591244-01-8 structure
Product Name:5-Chloro-2-methoxy-8-(methoxymethyl)quinoline
CAS No:591244-01-8
MF:C12H12ClNO2
MW:237.682182312012
CID:2833980
PubChem ID:71363722
Update Time:2025-04-21

5-Chloro-2-methoxy-8-(methoxymethyl)quinoline Chemical and Physical Properties

Names and Identifiers

    • 5-Chloro-2-methoxy-8-(methoxymethyl)quinoline
    • DTXSID30787231
    • 591244-01-8
    • Inchi: 1S/C12H12ClNO2/c1-15-7-8-3-5-10(13)9-4-6-11(16-2)14-12(8)9/h3-6H,7H2,1-2H3
    • InChI Key: UGHONAYCNVGVSU-UHFFFAOYSA-N
    • SMILES: ClC1=CC=C(COC)C2C1=CC=C(N=2)OC

Computed Properties

  • Exact Mass: 237.0556563Da
  • Monoisotopic Mass: 237.0556563Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 227
  • 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: 2.8
  • Topological Polar Surface Area: 31.4?2
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