Cas no 13169-71-6 ((4-Chlorophenyl)(1H-pyrrol-2-yl)methanone)

(4-Chlorophenyl)(1H-pyrrol-2-yl)methanone structure
13169-71-6 structure
Product Name:(4-Chlorophenyl)(1H-pyrrol-2-yl)methanone
CAS No:13169-71-6
MF:C11H8ClNO
MW:205.640321731567
MDL:MFCD00090258
CID:1104609
PubChem ID:640241
Update Time:2025-04-20

(4-Chlorophenyl)(1H-pyrrol-2-yl)methanone Chemical and Physical Properties

Names and Identifiers

    • (4-chlorophenyl)-1H-pyrrol-2-yl-Methanone
    • (4-chlorophenyl)-(1H-pyrrol-2-yl)methanone
    • (4-Chlorophenyl)(1H-pyrrol-2-yl)methanone
    • 2-(p-Chlorobenzoyl)pyrrole
    • Pyrrol-2-yl 4-chlorophenyl ketone
    • 2-(4-CHLOROBENZOYL)PYRROLE
    • 4-CHLOROPHENYL 2-PYRROLYL KETONE
    • (4-Chloro-phenyl)-(1H-pyrrol-2-yl)-methanone
    • AB03260
    • DB-257747
    • methanone, (4-chlorophenyl)-1H-pyrrol-2-yl-
    • 2-p-chlorobenzoylpyrrole
    • AC-29473
    • YTVORWPYOKKVAM-UHFFFAOYSA-N
    • 13169-71-6
    • AKOS013059887
    • MFCD00090258
    • F31020
    • AS-77397
    • InChI=1/C11H8ClNO/c12-9-5-3-8(4-6-9)11(14)10-2-1-7-13-10/h1-7,13
    • A888385
    • 2-(4-Chlorobenzoyl)-1H-pyrrole
    • (4-chlorophenyl)-1H-pyrrol-2-ylmethanone
    • CS-0155550
    • SCHEMBL6424225
    • AN-970/40920428
    • MDL： MFCD00090258
    • Inchi： 1S/C11H8ClNO/c12-9-5-3-8(4-6-9)11(14)10-2-1-7-13-10/h1-7,13H
    • InChI Key： YTVORWPYOKKVAM-UHFFFAOYSA-N
    • SMILES： ClC1C=CC(=CC=1)C(C1=CC=CN1)=O

Computed Properties

  • Exact Mass: 204.02171
  • Monoisotopic Mass: 205.0294416g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 211
  • 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: 3
  • Topological Polar Surface Area: 32.9?2

Experimental Properties

  • Density: 1.302±0.06 g/cm3 (20 oC 760 Torr),
  • Melting Point: 119 oC
  • Solubility: Almost insoluble (0.066 g/l) (25 o C),
  • PSA: 29.96

(4-Chlorophenyl)(1H-pyrrol-2-yl)methanone Pricemore >>

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