Cas no 106058-85-9 (1-(1-Tosyl-1h-pyrrol-3-yl)ethanone)

1-(1-Tosyl-1h-pyrrol-3-yl)ethanone structure
106058-85-9 structure
Product Name:1-(1-Tosyl-1h-pyrrol-3-yl)ethanone
CAS No:106058-85-9
MF:C13H13NO3S
MW:263.312222242355
MDL:MFCD00143087
CID:230775
PubChem ID:2737787
Update Time:2025-04-19

1-(1-Tosyl-1h-pyrrol-3-yl)ethanone Chemical and Physical Properties

Names and Identifiers

    • 1-(1-Tosyl-1H-pyrrol-3-yl)ethanone
    • 3-Acetyl-1-(p-tolylsulfonyl)pyrrole
    • 3-Acetyl-1-tosylpyrrole
    • 1-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]ethanone
    • 1-TOSYL-3-ACETYLPYRROLE
    • 3-ACETYL-N-TOSYLPYRROLE
    • 1-(4-Tolylsulfonyl)-3-acetylpyrrole
    • 1-{1-[(4-methylphenyl)sulfonyl]-1H-pyrrol-3-yl}ethanone
    • 1-[1-(4-methylbenzenesulfonyl)-1H-pyrrol-3-yl]ethan-1-one
    • 3-Acetyl-1-Tosyl Pyrrole
    • 1-Tosyl-3-acetyl-1H-pyrrole
    • NDOSNRLQNY
    • AB03834
    • MFCD00143087
    • 10.14272/NDOSNRLQNYYVKV-UHFFFAOYSA-N.1
    • doi:10.14272/NDOSNRLQNYYVKV-UHFFFAOYSA-N.2
    • DTXSID30372242
    • EN300-73220
    • CS-0153035
    • SCHEMBL4513102
    • NDOSNRLQNYYVKV-UHFFFAOYSA-N
    • A801369
    • AKOS005207823
    • 106058-85-9
    • doi:10.14272/NDOSNRLQNYYVKV-UHFFFAOYSA-N.1
    • Z1157653931
    • 10.14272/NDOSNRLQNYYVKV-UHFFFAOYSA-N.2
    • 1-[1-(p-tolylsulfonyl)pyrrol-3-yl]ethanone;1-TOSYL-3-ACETYLPYRROLE
    • BS-4814
    • STL301437
    • 1-[1-(4-methylbenzenesulfonyl)pyrrol-3-yl]ethanone
    • 1-(1-Tosyl-1h-pyrrol-3-yl)ethanone
    • MDL: MFCD00143087
    • Inchi: 1S/C13H13NO3S/c1-10-3-5-13(6-4-10)18(16,17)14-8-7-12(9-14)11(2)15/h3-9H,1-2H3
    • InChI Key: NDOSNRLQNYYVKV-UHFFFAOYSA-N
    • SMILES: S(C1C=CC(C)=CC=1)(N1C=CC(C(C)=O)=C1)(=O)=O

Computed Properties

  • Exact Mass: 263.06200
  • Monoisotopic Mass: 263.062
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 3
  • Complexity: 404
  • 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: 64.5
  • XLogP3: 1.9

Experimental Properties

  • Color/Form: Yellow to Brown Solid
  • Density: 1.24
  • Melting Point: 68-72°C
  • Boiling Point: 88-90 °C
  • Flash Point: 221.1 °C
  • Refractive Index: 1.591
  • PSA: 64.52000
  • LogP: 3.31690

1-(1-Tosyl-1h-pyrrol-3-yl)ethanone Security Information

1-(1-Tosyl-1h-pyrrol-3-yl)ethanone Customs Data

  • HS CODE:2933990090
  • Customs Data:

    China Customs Code:

    2933990090

    Overview:

    2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

1-(1-Tosyl-1h-pyrrol-3-yl)ethanone Pricemore >>

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1-(1-Tosyl-1h-pyrrol-3-yl)ethanone Production Method

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