Cas no 1020722-10-4 (3-(5-Bromo-1H-indol-3-yl)-3-oxopropanenitrile)

3-(5-Bromo-1H-indol-3-yl)-3-oxopropanenitrile structure
1020722-10-4 structure
Product Name:3-(5-Bromo-1H-indol-3-yl)-3-oxopropanenitrile
CAS No:1020722-10-4
MF:C11H7BrN2O
MW:263.090081453323
MDL:MFCD09839790
CID:2129625
PubChem ID:28306216
Update Time:2024-02-29

3-(5-Bromo-1H-indol-3-yl)-3-oxopropanenitrile Chemical and Physical Properties

Names and Identifiers

    • 3-(5-Bromoindol-3-yl)-3-oxopropanenitrile
    • 3‐(5‐bromo‐1H‐indol‐3‐yl)‐3‐oxopropanenitrile
    • 3-(5-bromo-1H-indol-3-yl)-3-oxopropanenitrile
    • STK939304
    • BBL031522
    • 7568AC
    • 1H-indole-3-propanenitrile, 5-bromo-beta-oxo-
    • 2-(5-bromo-1H-indol-3-yl)-2-oxoethyl cyanide
    • Z2469690455
    • 3-(5-Bromo-1H-indol-3-yl)-3-oxopropanenitrile
    • MDL: MFCD09839790
    • Inchi: 1S/C11H7BrN2O/c12-7-1-2-10-8(5-7)9(6-14-10)11(15)3-4-13/h1-2,5-6,14H,3H2
    • InChI Key: JNOHABODURGTQE-UHFFFAOYSA-N
    • SMILES: BrC1C=CC2=C(C=1)C(C(CC#N)=O)=CN2

Computed Properties

  • Exact Mass: 261.97418g/mol
  • Monoisotopic Mass: 261.97418g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 309
  • 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
  • Topological Polar Surface Area: 56.6
  • XLogP3: 2.3

3-(5-Bromo-1H-indol-3-yl)-3-oxopropanenitrile Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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Matrix Scientific
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A2B Chem LLC
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