Cas no 1463441-04-4 (5-bromo-6-chloro-3-methyl-1H-Pyrrolo[2,3-b]pyridine)

5-bromo-6-chloro-3-methyl-1H-Pyrrolo[2,3-b]pyridine structure
1463441-04-4 structure
Product Name:5-bromo-6-chloro-3-methyl-1H-Pyrrolo[2,3-b]pyridine
CAS No:1463441-04-4
MF:C8H6BrClN2
MW:245.5
MDL:MFCD28130155
CID:2135862
PubChem ID:119086727
Update Time:2024-11-04

5-bromo-6-chloro-3-methyl-1H-Pyrrolo[2,3-b]pyridine Chemical and Physical Properties

Names and Identifiers

    • 5-bromo-6-chloro-3-methyl-1H-Pyrrolo[2,3-b]pyridine
    • 1H-Pyrrolo[2,3-b]pyridine, 5-bromo-6-chloro-3-methyl-
    • CID 119086727
    • CS-0055972
    • E79936
    • 1463441-04-4
    • DA-37715
    • PS-16275
    • PB40728
    • MDL： MFCD28130155
    • Inchi： 1S/C8H6BrClN2/c1-4-3-11-8-5(4)2-6(9)7(10)12-8/h2-3H,1H3,(H,11,12)
    • InChI Key： KVTCKFGZYJKKIX-UHFFFAOYSA-N
    • SMILES： BrC1=C(N=C2C(=C1)C(C)=CN2)Cl

Computed Properties

  • Exact Mass: 243.94029g/mol
  • Monoisotopic Mass: 243.94029g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 178
  • 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: 28.7
  • XLogP3: 3.3

Experimental Properties

  • Density: 1.759±0.06 g/cm3(Predicted)
  • pka: 12.32±0.40(Predicted)

5-bromo-6-chloro-3-methyl-1H-Pyrrolo[2,3-b]pyridine Pricemore >>

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