Cas no 1823905-03-8 (Ethyl 4,5-dibromothiophene-3-carboxylate)

Ethyl 4,5-dibromothiophene-3-carboxylate structure
1823905-03-8 structure
Product Name:Ethyl 4,5-dibromothiophene-3-carboxylate
CAS No:1823905-03-8
MF:C7H6Br2O2S
MW:313.994339466095
CID:5746935
PubChem ID:72183260
Update Time:2023-11-11

Ethyl 4,5-dibromothiophene-3-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 4,5-dibromothiophene-3-carboxylate
    • EN300-7967365
    • 1823905-03-8
    • Ethyl4,5-dibromothiophene-3-carboxylate
    • 3-Thiophenecarboxylic acid, 4,5-dibromo-, ethyl ester
    • Inchi: 1S/C7H6Br2O2S/c1-2-11-7(10)4-3-12-6(9)5(4)8/h3H,2H2,1H3
    • InChI Key: ZJKKRSFGXOFNHV-UHFFFAOYSA-N
    • SMILES: BrC1=C(SC=C1C(=O)OCC)Br

Computed Properties

  • Exact Mass: 313.84348g/mol
  • Monoisotopic Mass: 311.84553g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 177
  • 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: 3.5
  • Topological Polar Surface Area: 54.5?2

Experimental Properties

  • Density: 1.895±0.06 g/cm3(Predicted)
  • Boiling Point: 308.8±37.0 °C(Predicted)

Ethyl 4,5-dibromothiophene-3-carboxylate Pricemore >>

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