Cas no 690266-87-6 (4-bromo-2-ethynylthiophene)

4-bromo-2-ethynylthiophene structure
4-bromo-2-ethynylthiophene structure
Product Name:4-bromo-2-ethynylthiophene
CAS No:690266-87-6
MF:C6H3BrS
MW:187.057019472122
MDL:MFCD08703539
CID:972947
PubChem ID:53426638
Update Time:2025-04-19

4-bromo-2-ethynylthiophene Chemical and Physical Properties

Names and Identifiers

    • 4-bromo-2-ethynyl-thiophene
    • 4-bromo-2-ethynylthiophene
    • DTXSID20699298
    • F2147-2788
    • SY277113
    • SCHEMBL4513432
    • EN300-1223571
    • CS-0225046
    • MFCD08703539
    • AKOS006237389
    • OKSJGYZPEOFUFQ-UHFFFAOYSA-N
    • A1-02151
    • 690266-87-6
    • A935123
    • MDL: MFCD08703539
    • Inchi: 1S/C6H3BrS/c1-2-6-3-5(7)4-8-6/h1,3-4H
    • InChI Key: OKSJGYZPEOFUFQ-UHFFFAOYSA-N
    • SMILES: BrC1=CSC(C#C)=C1

Computed Properties

  • Exact Mass: 185.91400
  • Monoisotopic Mass: 185.91388g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 1
  • Complexity: 124
  • 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: 2.6
  • Topological Polar Surface Area: 28.2?2

Experimental Properties

  • PSA: 28.24000
  • LogP: 2.49190

4-bromo-2-ethynylthiophene Pricemore >>

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