Cas no 56542-62-2 (3-Cyano-N-methylbenzenesulfonamide)

3-Cyano-N-methylbenzenesulfonamide is a sulfonamide derivative characterized by the presence of a cyano group at the 3-position and a methyl-substituted sulfonamide moiety. This compound is of interest in organic synthesis and pharmaceutical research due to its functional groups, which enable further derivatization and potential biological activity. The cyano group enhances reactivity in nucleophilic addition or reduction reactions, while the sulfonamide moiety offers opportunities for hydrogen bonding and interactions with biological targets. Its well-defined structure and purity make it suitable for use as an intermediate in the development of agrochemicals, pharmaceuticals, or specialty chemicals. The compound is typically handled under standard laboratory conditions, ensuring stability and ease of use in synthetic applications.
3-Cyano-N-methylbenzenesulfonamide structure
56542-62-2 structure
Product Name:3-Cyano-N-methylbenzenesulfonamide
CAS No:56542-62-2
MF:C8H8N2O2S
MW:196.226320266724
CID:1081469
PubChem ID:17561991
Update Time:2025-06-09

3-Cyano-N-methylbenzenesulfonamide Chemical and Physical Properties

Names and Identifiers

    • 3-Cyano-N-methylbenzenesulfonamide
    • 3-Cyan-benzolsulfonsaeure-methylamid
    • 3-cyano-benzenesulfonic acid methylamide
    • 3-cyano-N-methyl-benzenesulfonamide
    • Benzenesulfonamide,3-cyano-N-methyl
    • 56542-62-2
    • SCHEMBL4636711
    • UPCMLD0ENAT5819982:001
    • 3-cyano-N-methylbenzene-1-sulfonamide
    • MFCD09347282
    • EN300-36483
    • Z45527724
    • ZFSSELQTDZWFDQ-UHFFFAOYSA-N
    • DB-366401
    • DTXSID60589649
    • AKOS000188152
    • G26128
    • MDL: MFCD09347282
    • Inchi: 1S/C8H8N2O2S/c1-10-13(11,12)8-4-2-3-7(5-8)6-9/h2-5,10H,1H3
    • InChI Key: ZFSSELQTDZWFDQ-UHFFFAOYSA-N
    • SMILES: S(C1C=CC=C(C#N)C=1)(NC)(=O)=O

Computed Properties

  • Exact Mass: 196.03100
  • Monoisotopic Mass: 196.03064868g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 309
  • 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: 0.7
  • Topological Polar Surface Area: 78.3?2

Experimental Properties

  • Density: 1.362
  • Boiling Point: 355.771°C at 760 mmHg
  • Flash Point: 168.965°C
  • Refractive Index: 1.587
  • PSA: 78.34000
  • LogP: 1.93808

3-Cyano-N-methylbenzenesulfonamide Customs Data

  • HS CODE:2935009090
  • Customs Data:

    China Customs Code:

    2935009090

    Overview:

    2935009090 Other sulphonates(Acyl)amine. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:35.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2935009090 other sulphonamides VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:35.0%

3-Cyano-N-methylbenzenesulfonamide Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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56542-62-2 95%
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A2B Chem LLC
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A2B Chem LLC
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$1712.00 2024-04-19
A2B Chem LLC
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A2B Chem LLC
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$139.00 2024-04-19
A2B Chem LLC
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$185.00 2024-04-19
A2B Chem LLC
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$321.00 2024-04-19
A2B Chem LLC
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SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
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