Cas no 648412-57-1 (2-Furancarboxylic acid, 4-bromo-5-cyano-, methyl ester)

2-Furancarboxylic acid, 4-bromo-5-cyano-, methyl ester structure
648412-57-1 structure
Product Name:2-Furancarboxylic acid, 4-bromo-5-cyano-, methyl ester
CAS No:648412-57-1
MF:C7H4BrNO3
MW:230.015561103821
CID:415396
PubChem ID:68828530
Update Time:2025-04-19

2-Furancarboxylic acid, 4-bromo-5-cyano-, methyl ester Chemical and Physical Properties

Names and Identifiers

    • 2-Furancarboxylic acid, 4-bromo-5-cyano-, methyl ester
    • methyl 4-bromo-5-cyanofuran-2-carboxylate
    • Methyl 4-bromo-5-cyano-2-furoate
    • FT-0733413
    • 648412-57-1
    • DTXSID60739122
    • KPXZMJOVIGEKMD-UHFFFAOYSA-N
    • EN300-5179783
    • SCHEMBL3891860
    • TQP0713
    • Inchi： 1S/C7H4BrNO3/c1-11-7(10)5-2-4(8)6(3-9)12-5/h2H,1H3
    • InChI Key： KPXZMJOVIGEKMD-UHFFFAOYSA-N
    • SMILES： BrC1=C(C#N)OC(C(=O)OC)=C1

Computed Properties

  • Exact Mass: 228.93746g/mol
  • Monoisotopic Mass: 228.93746g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 234
  • 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: 1.9
  • Topological Polar Surface Area: 63.2?2

2-Furancarboxylic acid, 4-bromo-5-cyano-, methyl ester Pricemore >>

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