Cas no 1005650-19-0 (Ethyl 2-(4-bromo-1h-pyrazol-1-yl)butanoate)

Ethyl 2-(4-bromo-1h-pyrazol-1-yl)butanoate structure
1005650-19-0 structure
Product Name:Ethyl 2-(4-bromo-1h-pyrazol-1-yl)butanoate
CAS No:1005650-19-0
MF:C9H13BrN2O2
MW:261.115721464157
MDL:MFCD04969148
CID:1128191
PubChem ID:17024862
Update Time:2025-04-20

Ethyl 2-(4-bromo-1h-pyrazol-1-yl)butanoate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 2-(4-bromo-1h-pyrazol-1-yl)butanoate
    • EN300-229344
    • MFCD04969148
    • D79813
    • BBL039323
    • CS-0215237
    • AKOS000307807
    • STK313321
    • ethyl 2-(4-bromopyrazol-1-yl)butanoate
    • ethyl2-(4-bromo-1H-pyrazol-1-yl)butanoate
    • 1005650-19-0
    • 2-(4-Bromo-pyrazol-1-yl)-butyric acid ethyl ester
    • MDL: MFCD04969148
    • Inchi: 1S/C9H13BrN2O2/c1-3-8(9(13)14-4-2)12-6-7(10)5-11-12/h5-6,8H,3-4H2,1-2H3
    • InChI Key: MIHACXQYJIOCQM-UHFFFAOYSA-N
    • SMILES: BrC1C=NN(C=1)C(C(=O)OCC)CC

Computed Properties

  • Exact Mass: 260.01604g/mol
  • Monoisotopic Mass: 260.01604g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 5
  • Complexity: 201
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.2
  • Topological Polar Surface Area: 44.1?2

Ethyl 2-(4-bromo-1h-pyrazol-1-yl)butanoate Pricemore >>

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abcr
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abcr
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