Cas no 1167056-92-9 (6-Chloro-1H-pyrrolo[2,3-b]pyridine-4-carboxylic acid)

6-Chloro-1H-pyrrolo[2,3-b]pyridine-4-carboxylic acid structure
1167056-92-9 structure
Product Name:6-Chloro-1H-pyrrolo[2,3-b]pyridine-4-carboxylic acid
CAS No:1167056-92-9
MF:C8H5ClN2O2
MW:196.590500593185
MDL:MFCD12405099
CID:835130
PubChem ID:53399575
Update Time:2025-04-19

6-Chloro-1H-pyrrolo[2,3-b]pyridine-4-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 1H-Pyrrolo[2,3-b]pyridine-4-carboxylic acid, 6-chloro-
    • 6-CHLORO-1H-PYRROLO[2,3-B]PYRIDINE-4-CARBOXYLIC ACID
    • 6-Chloro-7-azaindole-4-carboxylic acid
    • WNHYMQCWBLAACO-UHFFFAOYSA-N
    • SB14231
    • FCH1152974
    • AK203731
    • SCHEMBL2158798
    • SY259998
    • ALBB-037061
    • AS-49456
    • CS-0004481
    • MFCD12405099
    • 6-chloro-1H-pyrrolo[2,3-b]pyridine-4-carboxylicacid
    • 1167056-92-9
    • AKOS025149193
    • I10576
    • 6-Chloro-1H-pyrrolo[2,3-b]pyridine-4-carboxylic acid
    • MDL: MFCD12405099
    • Inchi: 1S/C8H5ClN2O2/c9-6-3-5(8(12)13)4-1-2-10-7(4)11-6/h1-3H,(H,10,11)(H,12,13)
    • InChI Key: WNHYMQCWBLAACO-UHFFFAOYSA-N
    • SMILES: ClC1=CC(C(=O)O)=C2C=CNC2=N1

Computed Properties

  • Exact Mass: 196.0039551g/mol
  • Monoisotopic Mass: 196.0039551g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 224
  • 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: 66
  • XLogP3: 1.8

Experimental Properties

  • Density: 1.6±0.1 g/cm3

6-Chloro-1H-pyrrolo[2,3-b]pyridine-4-carboxylic acid Security Information

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