4-{[(4-Fluorophenyl)carbamoyl]amino}benzenesulfonamide

Basic Information

View in Editor

CAS Number

178606-66-1

Molecular Formula

C13H12FN3O3S

Molecular Weight

309.32 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Amines

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

242-243 ºC

Solubility

Insuluble (7.1E-3 g/L) (25 ºC),

SMILES

View in Editor

NS(=O)(=O)c1ccc(NC(=O)Nc2ccc(F)cc2)cc1

InChI

InChI=1S/C13H12FN3O3S/c14-9-1-3-10(4-2-9)16-13(18)17-11-5-7-12(8-6-11)21(15,19)20/h1-8H,(H2,15,19,20)(H2,16,17,18)

InChIKey

YJQZNWPYLCNRLP-UHFFFAOYSA-N

LogP

2.1171

Topological Polar Surface Area

101.28999999999999 Å²

Hydrogen Bond Donor/Acceptor

4 / 6

Complexity

450

Safety Information

View Safety Information

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H320 Causes eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

Benzenesulfonamide, 4-[[[(4-fluorophenyl)amino]carbonyl]amino]-
U-104
4-{[(4'-fluorophenyl)carbamoyl]amino}benzenesulfonamide
MST-104
U 104
U-104 NEW
Carbonic Anhydrase IX
NSC-213841
XII Inhibitor II(U-104)
NSC 213841
4-[[[(4-Fluorophenyl)amino]carbonyl]amino]-benzenesulfonamide
DNAJA4
MSTP104
PRO1472
SLC-0111
U-104 (NSC-213841)
Anti-DNAJA4 antibody produced in rabbit
MST104
1-(4-fluorophenyl)-3-(4-sulfamoylphenyl)urea
4-(3-(4-fluorophenyl)ureido)benzenesulfonamide
NSC213841
4-{[(4-Fluorophenyl)carbamoyl]amino}benzenesulfonamide
4-[3-(4-Fluorophenyl)ureido]benzenesulfonamide
WWZ
3n4b
GTPL10149
AOB5732
SLC0111
YJQZNWPYLCNRLP-UHFFFAOYSA-N
HMS3651H21
s2866

MDL Number

MFCD00159265

FAQ

What regulatory guidelines apply to 4-{[(4-Fluorophenyl)carbamoyl]amino}benzenesulfonamide (CAS: 178606-66-1)?

The compound 4-{[(4-Fluorophenyl)carbamoyl]amino}benzenesulfonamide (CAS: 178606-66-1) is subject to regulatory guidelines such as GHS (Global Harmonized System of Classification and Labeling of Chemicals) which defines its hazards. It is also regulated under REACH (Registration, Evaluation, Authorization, and Restriction of Chemicals) in the European Union, requiring manufacturers and importers to register the substance with the European Chemicals Agency. In the United States, it is subject to FDA (Food and Drug Administration) and EPA (Environmental Protection Agency) regulations for its intended use and disposal.

Are there alternatives to 4-{[(4-Fluorophenyl)carbamoyl]amino}benzenesulfonamide (CAS: 178606-66-1) in synthesis?

There are several alternatives to 4-{[(4-Fluorophenyl)carbamoyl]amino}benzenesulfonamide (CAS: 178606-66-1) that can be used in synthesis. For example, other sulfonamides with different substituents or analogs like 4-{[(3-Fluorophenyl)carbamoyl]amino}benzenesulfonamide can be considered. Additionally, isomers and related compounds can be explored as they may offer similar or enhanced properties for specific applications.

What is the market or research trend for 4-{[(4-Fluorophenyl)carbamoyl]amino}benzenesulfonamide (CAS: 178606-66-1)?

The market and research trends for 4-{[(4-Fluorophenyl)carbamoyl]amino}benzenesulfonamide (CAS: 178606-66-1) are focused on its applications in pharmaceuticals and organic synthesis. Recent research is exploring its use in drug discovery and as a potential lead compound for developing new therapeutic agents. Market trends indicate increasing demand driven by its unique chemical properties and potential in various applications.

How should waste containing 4-{[(4-Fluorophenyl)carbamoyl]amino}benzenesulfonamide (CAS: 178606-66-1) be handled?

Waste containing 4-{[(4-Fluorophenyl)carbamoyl]amino}benzenesulfonamide (CAS: 178606-66-1) should be handled by collecting it in appropriate containers and disposing of it through professional waste disposal services. Incineration is a common method, especially for hazardous waste. Environmental protection precautions include ensuring the waste is properly labeled and that all safety protocols are followed to prevent environmental contamination. It is crucial to consult local regulations and guidelines for specific disposal procedures.