Cas no 1467059-87-5 (5-bromo-6-chloro-1H-Indole-3-carboxaldehyde)

5-bromo-6-chloro-1H-Indole-3-carboxaldehyde structure
1467059-87-5 structure
Product Name:5-bromo-6-chloro-1H-Indole-3-carboxaldehyde
CAS No:1467059-87-5
MF:C9H5BrClNO
MW:258.5
MDL:MFCD27987751
CID:2114920
PubChem ID:86698566
Update Time:2025-11-06

5-bromo-6-chloro-1H-Indole-3-carboxaldehyde Chemical and Physical Properties

Names and Identifiers

    • 5-bromo-6-chloro-1H-Indole-3-carboxaldehyde
    • 5-bromo-6-chloro-1H-indole-3-carbaldehyde
    • 1H-Indole-3-carboxaldehyde, 5-bromo-6-chloro-
    • ISNMSGBNFQGRLG-UHFFFAOYSA-N
    • SB15080
    • CID 86698566
    • EN300-3251864
    • SY099482
    • DA-37718
    • Z1939441764
    • MFCD27987751
    • AS-43006
    • CS-0050580
    • SCHEMBL15300960
    • AKOS027252141
    • 1467059-87-5
    • MDL： MFCD27987751
    • Inchi： 1S/C9H5BrClNO/c10-7-1-6-5(4-13)3-12-9(6)2-8(7)11/h1-4,12H
    • InChI Key： ISNMSGBNFQGRLG-UHFFFAOYSA-N
    • SMILES： BrC1C(=CC2=C(C=1)C(C=O)=CN2)Cl

Computed Properties

  • Exact Mass: 256.92430g/mol
  • Monoisotopic Mass: 256.92430g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 214
  • 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: 32.9
  • XLogP3: 2.8

Experimental Properties

  • Density: 1.824±0.06 g/cm3(Predicted)
  • Boiling Point: 432.8±40.0 °C(Predicted)
  • pka: 13?+-.0.30(Predicted)

5-bromo-6-chloro-1H-Indole-3-carboxaldehyde Pricemore >>

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