3-Bromo-4-fluorobenzene-1-sulfonyl chloride

Basic Information

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CAS Number

631912-19-1

Molecular Formula

C6H3BrClFO2S

Molecular Weight

273.51 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

Density

1.867±0.06 g/cm3 (20 ºC 760 Torr),

SMILES

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C1=CC(=C(C=C1S(=O)(=O)Cl)Br)F

InChI

InChI=1S/C6H3BrClFO2S/c7-5-3-4(12(8,10)11)1-2-6(5)9/h1-3H

InChIKey

BEEHKBVVTWJSRH-UHFFFAOYSA-N

LogP

2.5157000000000007

Topological Polar Surface Area

34.14 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

251

Safety Information

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Hazard Statement

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

Hazard Class

Class 8 Class 8

Synonyms & References

English

3-Bromo-4-fluorobenzene-1-sulfonyl chloride
3-Bromo-4-fluorobenzenesulfonyl chloride
3-bromo-4-fluoro-benzenesulfonyl chloride
ACMC-209ndp
AK-90875
ANW-34571
CTK8B2060
I01-10795
KB-235020
BEEHKBVVTWJSRH-UHFFFAOYSA-N
NE15686
4-fluoro-5-bromobenzenesulfonyl chloride
SY042918
ST24022735
V7007
3-Bromo-4-fluorobenzene-1-sulfonyl chloride, AldrichCPR
3-bromo-4-fluorobenzene-1-sulfonyl chloride
DB-315195
DTXSID80619457
SCHEMBL5839980
AKOS015151107
PB43196
MFCD13185363
3-Bromo-4-fluorobenzenesulphonyl chloride
631912-19-1
EN300-95988
3-Bromo-4-fluoro-benzenesulfonyl chloride
CS-W005732
3-Bromo-4-fluorobenzene-1-sulfonylchloride
AS-18027

MDL Number

MFCD13185363

FAQ

What is 3-Bromo-4-fluorobenzene-1-sulfonyl chloride (CAS: 631912-19-1)?

3-Bromo-4-fluorobenzene-1-sulfonyl chloride (CAS: 631912-19-1) is an organic compound with a molecular formula of C9H6BrClFOS. It is an aromatic sulfonyl halide with a broad range of chemical and physical properties, including low melting and boiling points, and is highly soluble in organic solvents.

What are the main uses of 3-Bromo-4-fluorobenzene-1-sulfonyl chloride (CAS: 631912-19-1)?

3-Bromo-4-fluorobenzene-1-sulfonyl chloride (CAS: 631912-19-1) is primarily used in the synthesis of pharmaceuticals, dyes, and intermediates. It plays a critical role in organic synthesis due to its functional groups, which facilitate various chemical reactions.

Is 3-Bromo-4-fluorobenzene-1-sulfonyl chloride (CAS: 631912-19-1) safe?

3-Bromo-4-fluorobenzene-1-sulfonyl chloride (CAS: 631912-19-1) is generally safe when handled with proper precautions. However, it is corrosive and can irritate the skin and eyes. Users should wear protective equipment such as gloves and goggles, and ensure adequate ventilation. Avoid contact with water, as it can cause a violent reaction.

How should 3-Bromo-4-fluorobenzene-1-sulfonyl chloride (CAS: 631912-19-1) be stored?

3-Bromo-4-fluorobenzene-1-sulfonyl chloride (CAS: 631912-19-1) should be stored in a cool, dry place away from direct sunlight and sources of heat. It should be kept in a tightly sealed container to prevent exposure to moisture and air. Ideal storage conditions include a temperature range of 15-25°C and a relative humidity below 60%.