5-(Chlorosulfonyl)-2-fluorobenzoic acid

Basic Information

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CAS Number

37098-75-2

Molecular Formula

C7H4ClFO4S

Molecular Weight

238.62 g/mol

Basic Physical Properties

Melting Point

111-113°C

Boiling Point

404°C at 760 mmHg

SMILES

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OC(=O)c1cc(ccc1F)S(=O)(=O)Cl

InChI

InChI=1S/C7H4ClFO4S/c8-14(12,13)4-1-2-6(9)5(3-4)7(10)11/h1-3H,(H,10,11)

InChIKey

CISMZCVQNVNWJW-UHFFFAOYSA-N

LogP

1.4514

Topological Polar Surface Area

71.44 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

323

Safety Information

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Hazard Statement

H314 Causes severe skin burns and eye damage
Skin corrosion/irritation

H318 Causes serious eye damage
Serious eye damage/eye irritation

Hazard Class

Class 8 Class 8

Sensitiveness

Moisture Sensitive

Synonyms & References

English

5-(Chlorosulfonyl)-2-fluorobenzoic acid
5-Chlorosulfonyl-2-fluorobenzoic acid
2-Fluoro-5-(chlorosulfonyl)benzoic acid
2-fluoro-5-chlorosulfonylbenzoic acid
5-(CHLOROSULPHONYL)-2-FLUOROBENZOIC ACID
2-Fluoro-5-(chlorosulfonyl)benzoic acid
5-Chlorosulfonyl-2-fluoro-benzoic acid
CISMZCVQNVNWJW-UHFFFAOYSA-N
5-(Chlorosulfonyl)-2-fluorobenzoicacid
KSC577O0R
BENZOIC ACID, 5-(CHLOROSULFONYL)-2-FLUORO-
SBB078627
RW2695
2-fluoro-5-chlo
5-chlorosulfonyl-2-fluoro-benzoic acid

MDL Number

MFCD03030335

Customs Code

2916399090

FAQ

What regulatory guidelines apply to 5-(Chlorosulfonyl)-2-fluorobenzoic acid (CAS: 37098-75-2)?

5-(Chlorosulfonyl)-2-fluorobenzoic acid (CAS: 37098-75-2) falls under the regulatory guidelines set by the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), which includes classification for environmental hazards, flammability, and reactivity. Additionally, it complies with the REACH regulations in the European Union, and the FDA and EPA have specific requirements for handling and disposal in the United States. Proper documentation and labeling are essential to ensure compliance with these regulations.

Are there alternatives to 5-(Chlorosulfonyl)-2-fluorobenzoic acid (CAS: 37098-75-2) in synthesis?

For synthesis, alternatives to 5-(Chlorosulfonyl)-2-fluorobenzoic acid (CAS: 37098-75-2) can include other sulfonic acid derivatives or fluoroaromatic compounds. Common substitutes include 2-fluorobenzoic acid, benzenesulfonyl chloride, and other related compounds. These can serve similar functions in reactions, but the choice depends on the specific application and desired product properties.

What is the market or research trend for 5-(Chlorosulfonyl)-2-fluorobenzoic acid (CAS: 37098-75-2)?

The market for 5-(Chlorosulfonyl)-2-fluorobenzoic acid (CAS: 37098-75-2) is driven by its use in pharmaceuticals, agrochemicals, and research for novel drug development. Research trends focus on improving synthesis methods, exploring its properties in catalysis, and investigating its role in functional materials. There is also interest in green chemistry approaches to reduce environmental impact while maintaining its effectiveness in various applications.

How should waste containing 5-(Chlorosulfonyl)-2-fluorobenzoic acid (CAS: 37098-75-2) be handled?

Waste containing 5-(Chlorosulfonyl)-2-fluorobenzoic acid (CAS: 37098-75-2) should be collected in appropriate containers and stored separately to prevent contamination. Incineration is a common method for disposal, but professional waste disposal services should be used to ensure compliance with environmental regulations. Proper protective equipment and safety measures must be followed during handling to avoid exposure and environmental contamination. Compliance with local hazardous waste regulations is essential.