2-(Trifluoromethyl)benzenesulfonyl chloride

Basic Information

View in Editor

CAS Number

776-04-5

Molecular Formula

C7H4ClF3O2S

Molecular Weight

244.62 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

Melting Point

25°C

Boiling Point

126°C/5mmHg

Density

1.585 g/mL at 25 °C

Flash Point

>230 °F

Refractive Index

n20/D 1.503(lit.)

SMILES

View in Editor

C1=CC=C(C(=C1)C(F)(F)F)S(=O)(=O)Cl

InChI

InChI=1S/C7H4ClF3O2S/c8-14(12,13)6-4-2-1-3-5(6)7(9,10)11/h1-4H

InChIKey

ZIZGWNOAHUCACM-UHFFFAOYSA-N

LogP

2.6329000000000002

Topological Polar Surface Area

34.14 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

293

Safety Information

View Safety Information

Hazard Statement

H290 May be corrosive to metals
Corrosive to Metals

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

H341 Suspected of causing genetic defects
Germ cell mutagenicity

Hazard Class

Class 8 Class 8

Sensitiveness

Moisture Sensitive

Synonyms & References

English

SCHEMBL65955
2-(trifluoromethyl)benzenesulphonyl chloride
CS-W004100
CK2507
2-trifluoromethyl benzene sulfonyl chloride
2-(trifluoromethyl)-benzenesulfonyl chloride
2-Trifluoromethylbenzenesulfonyl chloride
AS-45917
EC 700-328-0
A24454
DTXSID00228262
2-(Trifluoromethyl)benzenesulfonyl chloride
Z56948352
Benzenesulfonyl chloride, 2-(trifluoromethyl)-
RH4NT3SSP4
2-(trifluoromethyl)phenylsulfonyl chloride
o-(trifluoromethyl)benzenesulfonyl chloride
AKOS000268846
2-(Trifluoromethyl)Benzene-1-Sulfonyl Chloride
F9995-0239
2-(trifluoromethyl)benzenesulfonylchloride
2-(Trifluoromethyl)benzenesulfonyl chloride, 97%
2-trifluoromethylbenzene-sulfonyl chloride
AM20041164
EN300-17526
2-(trifluoromethyl)benzene sulfonyl chloride
2-trifluoromethylbenzene-1-sulfonyl chloride
NS00001586
MFCD00051696
FT-0608762
2-Trifluoromethylbenzenesulphonyl chloride

MDL Number

MFCD00051696

Customs Code

2904909090

FAQ

What regulatory guidelines apply to 2-(Trifluoromethyl)benzenesulfonyl chloride (CAS: 776-04-5)?

2-(Trifluoromethyl)benzenesulfonyl chloride (CAS: 776-04-5) must comply with the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations in the European Union, and FDA/EPA requirements for chemical substances. Proper handling, storage, and disposal procedures should be adhered to for safety and environmental protection.

Are there alternatives to 2-(Trifluoromethyl)benzenesulfonyl chloride (CAS: 776-04-5) in synthesis?

While 2-(Trifluoromethyl)benzenesulfonyl chloride (CAS: 776-04-5) is a versatile reagent, alternatives such as trifluoromethylbenzenesulfonyl fluoride and other sulfur yl chlorides can be used in synthesis. The choice depends on the specific reaction conditions and desired product.

What is the market or research trend for 2-(Trifluoromethyl)benzenesulfonyl chloride (CAS: 776-04-5)?

The market for 2-(Trifluoromethyl)benzenesulfonyl chloride (CAS: 776-04-5) is growing due to its wide applications in pharmaceuticals and agrochemicals. Research trends focus on exploring its use in novel drug discovery and developing more environmentally friendly synthesis methods.

How should waste containing 2-(Trifluoromethyl)benzenesulfonyl chloride (CAS: 776-04-5) be handled?

Waste containing 2-(Trifluoromethyl)benzenesulfonyl chloride (CAS: 776-04-5) should be collected in sealed containers and disposed of according to local regulations. Incineration or professional waste disposal services are recommended to ensure proper treatment and minimize environmental impact.