Cas no 1254110-85-4 (1-(4,5-Dichloro-1H-pyrrol-2-yl)ethanone)

1-(4,5-Dichloro-1H-pyrrol-2-yl)ethanone structure
1254110-85-4 structure
Product Name:1-(4,5-Dichloro-1H-pyrrol-2-yl)ethanone
CAS No:1254110-85-4
MF:C6H5Cl2NO
MW:178.015999555588
MDL:MFCD23378942
CID:1088907
PubChem ID:71485911
Update Time:2025-04-20

1-(4,5-Dichloro-1H-pyrrol-2-yl)ethanone Chemical and Physical Properties

Names and Identifiers

    • 1-(4,5-Dichloro-1H-pyrrol-2-yl)ethanone
    • DTXSID10856131
    • Ethanone, 1-(4,5-dichloro-1H-pyrrol-2-yl)-
    • SCHEMBL18136104
    • 5-acetyl-2,3-dichloropyrrole
    • 1254110-85-4
    • SB62457
    • 1-(4,5-Dichloro-1H-pyrrol-2-yl)ethan-1-one
    • MDL： MFCD23378942
    • Inchi： 1S/C6H5Cl2NO/c1-3(10)5-2-4(7)6(8)9-5/h2,9H,1H3
    • InChI Key： QFUQUALBSJJVQO-UHFFFAOYSA-N
    • SMILES： ClC1=C(C=C(C(C)=O)N1)Cl

Computed Properties

  • Exact Mass: 176.9748192g/mol
  • Monoisotopic Mass: 176.9748192g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 151
  • 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
  • XLogP3: 2.3
  • Topological Polar Surface Area: 32.9?2

1-(4,5-Dichloro-1H-pyrrol-2-yl)ethanone Pricemore >>

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