Cas no 4404-11-9 (4-Chloro-1H-indole-2-carbonitrile)

4-Chloro-1H-indole-2-carbonitrile structure
4404-11-9 structure
Product Name:4-Chloro-1H-indole-2-carbonitrile
CAS No:4404-11-9
MF:C9H5ClN2
MW:176.602400541306
MDL:MFCD23135759
CID:1038471
PubChem ID:14081539
Update Time:2025-11-04

4-Chloro-1H-indole-2-carbonitrile Chemical and Physical Properties

Names and Identifiers

    • 4-Chloro-1H-indole-2-carbonitrile
    • 1H-Indole-2-carbonitrile, 4-chloro-
    • AGN-PC-000CE4
    • AK100663
    • ANW-70036
    • CTK8C3391
    • KB-241064
    • 6081AB
    • FCH1870040
    • AX8241591
    • ST24023452
    • DTXSID50555570
    • SCHEMBL18292208
    • DS-3585
    • A924202
    • O11198
    • AKOS016001568
    • 4404-11-9
    • MFCD23135759
    • MDL： MFCD23135759
    • Inchi： 1S/C9H5ClN2/c10-8-2-1-3-9-7(8)4-6(5-11)12-9/h1-4,12H
    • InChI Key： FDAFJTFFVWHCOX-UHFFFAOYSA-N
    • SMILES： ClC1=CC=CC2=C1C=C(C#N)N2

Computed Properties

  • Exact Mass: 176.01425
  • Monoisotopic Mass: 176.0141259g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 220
  • 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: 39.6
  • XLogP3: 2.7

Experimental Properties

  • PSA: 39.58

4-Chloro-1H-indole-2-carbonitrile Security Information

  • Signal Word：Warning
  • Hazard Statement： H302
  • Warning Statement： P280-P305+P351+P338
  • Storage Condition：Sealed in dry,Room Temperature

4-Chloro-1H-indole-2-carbonitrile Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Alichem
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4-Chloro-1H-indole-2-carbonitrile
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 $ 50.00 2022-06-06
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 $ 160.00 2022-06-06
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SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd.
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