Cas no 62224-18-4 (tert-butyl 4-bromothiophene-2-carboxylate)

tert-butyl 4-bromothiophene-2-carboxylate structure
62224-18-4 structure
Product Name:tert-butyl 4-bromothiophene-2-carboxylate
CAS No:62224-18-4
MF:C9H11BrO2S
MW:263.151440858841
MDL:MFCD06657474
CID:453699
PubChem ID:10612011
Update Time:2025-09-18

tert-butyl 4-bromothiophene-2-carboxylate Chemical and Physical Properties

Names and Identifiers

    • 2-Thiophenecarboxylic acid, 4-bromo-, 1,1-dimethylethyl ester
    • tert-butyl 4-bromothiophene-2-carboxylate
    • AKOS021982162
    • tert-butyl 4-bromo-2-thiophenecarboxylate
    • AT30703
    • EN300-8259727
    • 62224-18-4
    • SCHEMBL1753907
    • DTXSID40442526
    • MDL: MFCD06657474
    • Inchi: 1S/C9H11BrO2S/c1-9(2,3)12-8(11)7-4-6(10)5-13-7/h4-5H,1-3H3
    • InChI Key: JSVLFCAWAIQQHQ-UHFFFAOYSA-N
    • SMILES: BrC1=CSC(=C1)C(=O)OC(C)(C)C

Computed Properties

  • Exact Mass: 261.96633
  • Monoisotopic Mass: 261.96631g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 200
  • 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

  • PSA: 26.3

tert-butyl 4-bromothiophene-2-carboxylate Pricemore >>

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