2,6-Difluoro-3-[(propylsulfonyl)amino]benzoic acid

Basic Information

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CAS Number

1103234-56-5

Molecular Formula

C10H11F2NO4S

Molecular Weight

279.26 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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CCCS(=O)(=O)Nc1ccc(c(c1F)C(=O)O)F

InChI

InChI=1S/C10H11F2NO4S/c1-2-5-18(16,17)13-7-4-3-6(11)8(9(7)12)10(14)15/h3-4,13H,2,5H2,1H3,(H,14,15)

InChIKey

RTAWCKGXCGSFJI-UHFFFAOYSA-N

LogP

1.8147000000000002

Topological Polar Surface Area

83.47 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

395

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

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

Synonyms & References

English

2,6-Difluoro-3-(propylsulfonamido)benzoic acid
2,6-Difluoro-3-(propane-1-sulfonamido)benzoic acid
2,6-difluoro-3-(propane-1-sulfonylamino)benzoic acid
2,6-difluoro-3-(propylsulfonylamino)benzoic acid
2,6-Difluoro-3-[(propylsulfonyl)amino]benzoic acid
5-aMino-3-(4-phenoxyphenyl)-1H-pyrazole-4-carbonitrile
2,6-Difluoro-3-[[(propan-1-yl)sulfonyl]amino]benzoic acid
2.6-difluoro-3-(propylsulfonamido)benzoic acid
AK110017
2,6-DIFLUORO-3-(PROPYLSULFONAMIDO)BENZOIC ACID;2,6-Difluoro-3-(propylsulfonamido)benzoic acid
C10H11F2NO4S
RTAWCKGXCGSFJI-UHFFFAOYSA-N
difluoropropanesulfonamidobenzoicacid
RW4139
RP15433
IMED2168703961
QC-
2,6-Difluoro-3-[(propane-1-sulfonyl)amino]benzoic acid

MDL Number

MFCD18157658

Customs Code

2935009090

FAQ

What regulatory guidelines apply to 2,6-Difluoro-3-[(propylsulfonyl)amino]benzoic acid (CAS: 1103234-56-5)?

2,6-Difluoro-3-[(propylsulfonyl)amino]benzoic acid (CAS: 1103234-56-5) is subject to various regulatory frameworks. Under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), it may be classified as a hazardous substance based on its physical and chemical properties. In Europe, it is covered by REACH regulations, which require registration if produced or imported in quantities above one tonne per year. In the United States, FDA and EPA regulations may apply for its use in pharmaceutical or agricultural products. Ensure compliance with local and international laws for handling, storage, and disposal.

Are there alternatives to 2,6-Difluoro-3-[(propylsulfonyl)amino]benzoic acid in synthesis?

Alternatives to 2,6-Difluoro-3-[(propylsulfonyl)amino]benzoic acid in synthesis include related compounds such as 2,6-difluorobenzoic acid or 3-(propylsulfonylamino)benzoic acid. These alternatives can be used as precursors or as the final product in different chemical processes. Common reagents for synthesis include propylsulfonyl chloride and appropriate amines. It's important to evaluate the availability, cost, and reactivity of these alternatives to find the most suitable one for your specific application.

What is the market or research trend for 2,6-Difluoro-3-[(propylsulfonyl)amino]benzoic acid?

The market for 2,6-Difluoro-3-[(propylsulfonyl)amino]benzoic acid (CAS: 1103234-56-5) is primarily driven by its applications in pharmaceuticals and agrochemicals. Recent research trends focus on its use as an intermediate in the synthesis of new drugs and as a fungicide active ingredient. Market demand is expected to grow due to ongoing drug development and increasing agricultural needs. However, price trends may vary based on supply and demand dynamics and production costs.

How should waste containing 2,6-Difluoro-3-[(propylsulfonyl)amino]benzoic acid be handled?

Waste containing 2,6-Difluoro-3-[(propylsulfonyl)amino]benzoic acid (CAS: 1103234-56-5) should be managed in accordance with local and international waste disposal regulations. Collect waste liquids in appropriate containers and ensure proper ventilation during handling. Incineration is a common disposal method, but professional waste disposal services are recommended for larger quantities or hazardous waste. Implement safety precautions such as wearing protective gear and following proper procedures to prevent environmental contamination and ensure worker safety.