Cas no 918519-00-3 (Quinoline, 2,6-dichloro-3-(phenylmethyl)-)

Quinoline, 2,6-dichloro-3-(phenylmethyl)- structure
918519-00-3 structure
Product Name:Quinoline, 2,6-dichloro-3-(phenylmethyl)-
CAS No:918519-00-3
MF:C16H11Cl2N
MW:288.171241998672
CID:773908
PubChem ID:59444022
Update Time:2025-04-19

Quinoline, 2,6-dichloro-3-(phenylmethyl)- Chemical and Physical Properties

Names and Identifiers

    • Quinoline, 2,6-dichloro-3-(phenylmethyl)-
    • 3-benzyl-2,6-dichloroquinoline
    • DTXSID70732048
    • 918519-00-3
    • SCHEMBL13227193
    • AKOS015958865
    • Inchi: 1S/C16H11Cl2N/c17-14-6-7-15-12(10-14)9-13(16(18)19-15)8-11-4-2-1-3-5-11/h1-7,9-10H,8H2
    • InChI Key: KOUBQILEHSJTPY-UHFFFAOYSA-N
    • SMILES: ClC1=C(C=C2C=C(C=CC2=N1)Cl)CC1C=CC=CC=1

Computed Properties

  • Exact Mass: 287.0268547g/mol
  • Monoisotopic Mass: 287.0268547g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 2
  • Complexity: 291
  • 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: 5.7
  • Topological Polar Surface Area: 12.9?2
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