Cas no 3077-61-0 (Benzenesulfonamide,4-hydroxy-N-methyl-)

4-Hydroxy-N-methylbenzenesulfonamide is a sulfonamide derivative characterized by the presence of a hydroxyl group and a methyl-substituted sulfonamide moiety on a benzene ring. This compound is of interest in organic synthesis and pharmaceutical research due to its versatile functional groups, which enable further derivatization. The hydroxyl group enhances solubility in polar solvents, while the sulfonamide moiety offers potential for hydrogen bonding and coordination, making it useful in ligand design or intermediate applications. Its structural features may also contribute to biological activity, though specific properties depend on the context of use. The compound is typically handled under standard laboratory conditions, with attention to compatibility in reactions involving its reactive sites.
Benzenesulfonamide,4-hydroxy-N-methyl- structure
3077-61-0 structure
Product Name:Benzenesulfonamide,4-hydroxy-N-methyl-
CAS No:3077-61-0
MF:C7H9NO3S
MW:187.216260671616
CID:311266
PubChem ID:76502
Update Time:2025-05-21

Benzenesulfonamide,4-hydroxy-N-methyl- Chemical and Physical Properties

Names and Identifiers

    • Benzenesulfonamide,4-hydroxy-N-methyl-
    • 4-hydroxy-N-methylbenzenesulfonamide
    • Q27236523
    • Benzenesulfonamide, 4-hydroxy-N-methyl-
    • Phenol, p-(N-methylsulfamoyl)-
    • BRN 2098803
    • EN300-6766603
    • RHPDIBUPEZIAAU-UHFFFAOYSA-N
    • 4-hydroxy-n-methylbenzene-1-sulfonamide
    • N-methyl-4-hydroxybenzenesulfonamide
    • Benzenesulfonamide, p-hydroxy-N-methyl-
    • DTXSID30184786
    • N-METHYL-1-PHENOL-4-SULFONAMIDE
    • Z381036150
    • SCHEMBL7020553
    • CS-0437742
    • 3077-61-0
    • UNII-0A4V3504L6
    • 0A4V3504L6
    • N-Methylsulfamoylphenol
    • Inchi: 1S/C7H9NO3S/c1-8-12(10,11)7-4-2-6(9)3-5-7/h2-5,8-9H,1H3
    • InChI Key: RHPDIBUPEZIAAU-UHFFFAOYSA-N
    • SMILES: S(C1C=CC(=CC=1)O)(NC)(=O)=O

Computed Properties

  • Exact Mass: 187.03037
  • Monoisotopic Mass: 187.030314
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 224
  • 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: 0.9
  • Topological Polar Surface Area: 74.8

Experimental Properties

  • Density: 1.352
  • Boiling Point: 354.2°Cat760mmHg
  • Flash Point: 168°C
  • Refractive Index: 1.569
  • PSA: 66.4

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Additional information on Benzenesulfonamide,4-hydroxy-N-methyl-

Benzenesulfonamide,4-hydroxy-N-methyl- (CAS No. 3077-61-0): A Comprehensive Overview of Its Chemical Properties and Emerging Applications

Benzenesulfonamide,4-hydroxy-N-methyl- (CAS No. 3077-61-0) is a sulfonamide derivative that has garnered significant attention in the field of chemical biology and pharmaceutical research due to its unique structural properties and potential therapeutic applications. This compound, characterized by a benzene ring substituted with a sulfonamide group and a hydroxyl group at the 4-position, along with a methyl group at the N-position, exhibits distinct chemical and biological characteristics that make it a valuable candidate for further investigation.

The chemical structure of Benzenesulfonamide,4-hydroxy-N-methyl- (CAS No. 3077-61-0) consists of a benzene core linked to a sulfonamide moiety (-SO?NH?), with modifications at the 4-position and the nitrogen atom. The presence of the hydroxyl group at the 4-position introduces polarity and potential hydrogen bonding capabilities, while the methyl group at the nitrogen enhances the compound's solubility and reactivity. These structural features contribute to its versatility in various chemical and biological interactions.

In recent years, Benzenesulfonamide,4-hydroxy-N-methyl- (CAS No. 3077-61-0) has been studied for its potential role in drug development. Sulfonamide derivatives are well-known for their antimicrobial and anti-inflammatory properties, and this compound is no exception. The sulfonamide group is particularly effective in disrupting bacterial cell wall synthesis, making it a promising candidate for antibiotics. Additionally, the hydroxyl and methyl groups may enhance binding affinity to biological targets, improving drug efficacy.

One of the most compelling aspects of Benzenesulfonamide,4-hydroxy-N-methyl- (CAS No. 3077-61-0) is its potential application in targeted therapy. Researchers have been exploring its use in developing drugs that specifically target cancer cells without harming healthy tissues. The compound's ability to interact with enzymes and receptors overexpressed in certain cancer types makes it an attractive candidate for personalized medicine approaches. Preliminary studies have shown promising results in inhibiting tumor growth in vitro, suggesting its potential as an anticancer agent.

The synthesis of Benzenesulfonamide,4-hydroxy-N-methyl- (CAS No. 3077-61-0) involves multi-step organic reactions that require precise control over reaction conditions to ensure high yield and purity. The process typically begins with the functionalization of a benzene ring to introduce the sulfonamide group, followed by modifications at the 4-position and nitrogen atom. Advanced synthetic techniques such as catalytic hydrogenation and nucleophilic substitution reactions are often employed to achieve the desired structure efficiently.

The physicochemical properties of Benzenesulfonamide,4-hydroxy-N-methyl- (CAS No. 3077-61-0) are also of great interest. Its solubility in both polar and non-polar solvents makes it suitable for various formulation strategies in drug delivery systems. Additionally, its stability under different storage conditions ensures that it can be effectively used in pharmaceutical applications without degradation over time.

In conclusion, Benzenesulfonamide,4-hydroxy-N-methyl- (CAS No. 3077-61-0) is a multifaceted compound with significant potential in pharmaceutical research and development. Its unique structural features make it an effective candidate for antimicrobial agents, anti-inflammatory drugs, and targeted cancer therapies. Further research is needed to fully elucidate its mechanisms of action and optimize its therapeutic applications.

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