Cas no 1070879-45-6 (4-bromo-8-ethyl-2-methylquinoline)

4-bromo-8-ethyl-2-methylquinoline structure
1070879-45-6 structure
Product Name:4-bromo-8-ethyl-2-methylquinoline
CAS No:1070879-45-6
MF:C12H12BrN
MW:250.134382247925
CID:1185719
PubChem ID:39346138
Update Time:2025-10-28

4-bromo-8-ethyl-2-methylquinoline Chemical and Physical Properties

Names and Identifiers

    • 4-bromo-8-ethyl-2-methylquinoline
    • CTK4A4974
    • ZINC32099861
    • AG-D-21971
    • KB-240892
    • CTK4A4974; ZINC32099861; AG-D-21971; KB-240892;
    • SB69922
    • DTXSID80653694
    • MFCD11505129
    • 1070879-45-6
    • Inchi: 1S/C12H12BrN/c1-3-9-5-4-6-10-11(13)7-8(2)14-12(9)10/h4-7H,3H2,1-2H3
    • InChI Key: FNIYMSFLQVYRBU-UHFFFAOYSA-N
    • SMILES: BrC1C=C(C)N=C2C=1C=CC=C2CC

Computed Properties

  • Exact Mass: 249.01500
  • Monoisotopic Mass: 249.01531g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 195
  • 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: 4.1
  • Topological Polar Surface Area: 12.9?2

Experimental Properties

  • PSA: 12.89000
  • LogP: 3.86810

4-bromo-8-ethyl-2-methylquinoline Pricemore >>

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