Cas no 1007517-56-7 (3-(4-bromo-1H-pyrazol-1-yl)butanoic acid)

3-(4-bromo-1H-pyrazol-1-yl)butanoic acid structure
1007517-56-7 structure
Product Name:3-(4-bromo-1H-pyrazol-1-yl)butanoic acid
CAS No:1007517-56-7
MF:C7H9BrN2O2
MW:233.062560796738
CID:4558945
PubChem ID:23006111
Update Time:2024-03-01

3-(4-bromo-1H-pyrazol-1-yl)butanoic acid Chemical and Physical Properties

Names and Identifiers

    • 3-(4-bromo-1H-pyrazol-1-yl)butanoic acid
    • 1H-Pyrazole-1-propanoic acid, 4-bromo-β-methyl-
    • Inchi: 1S/C7H9BrN2O2/c1-5(2-7(11)12)10-4-6(8)3-9-10/h3-5H,2H2,1H3,(H,11,12)
    • SMILES: C(O)(=O)CC(N1C=C(Br)C=N1)C

Computed Properties

  • Exact Mass: 231.98474g/mol
  • Monoisotopic Mass: 231.98474g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • 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 : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Molecular Weight: 233.06g/mol
  • XLogP3: 0.8
  • Topological Polar Surface Area: 55.1?2

3-(4-bromo-1H-pyrazol-1-yl)butanoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Chemenu
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SHANG HAI BI DE YI YAO KE JI GU FEN Co., Ltd.
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