4-Bromobenzoyl chloride

Basic Information

View in Editor

CAS Number

586-75-4

Molecular Formula

C7H4BrClO

Molecular Weight

219.46 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

38.0 to 41.0 deg-C

Boiling Point

247°C

Water Solubility

Soluble in methanol. Reacts with water forming Hcl.

Refractive Index

1.5963 (estimate)

SMILES

View in Editor

C1=CC(=CC=C1C(=O)Cl)Br

InChI

InChI=1S/C7H4BrClO/c8-6-3-1-5(2-4-6)7(9)10/h1-4H

InChIKey

DENKGPBHLYFNGK-UHFFFAOYSA-N

LogP

2.828100000000001

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

130

Safety Information

View Safety Information

GHS Hazard Pictograms

H314

Hazard Statement

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

Hazard Class

Class 8 Class 8

Sensitiveness

Moisture Sensitive

Synonyms & References

English

AKOS009031172
4-bromo-benzoyl-chloride
4bromobenzoyl chloride
EINECS 209-580-1
A831975
NSC-7091
SCHEMBL1088
W-105370
p-Bromobenzoyl chloride
parabromobenzoyl chloride
4-bromo-benzoylchloride
DTXSID2060412
4-Bromobenzoyl chloride
FT-0601037
586-75-4
4-bromo-benzoyl chloride
EN300-21294
W72HA95JJC
4-Bromobenzoylchloride
p-BrC6H4COCl
4-Bromo-1-benzenecarbonyl chloride
NS00033992
rho-bromobenzoyl chloride
NSC 7091
4-Bromo benzoyl chloride
B0558
Benzoyl chloride, p-bromo-
NSC7091
p-Bromobenzoyl chloride, p-bromo-
4-bromobenzoic acid chloride
Benzoyl chloride, 4-bromo-

MDL Number

MFCD00000683

Customs Code

29163900

FAQ

What regulatory guidelines apply to 4-Bromobenzoyl chloride (CAS: 586-75-4)?

4-Bromobenzoyl chloride (CAS: 586-75-4) is classified as a hazardous substance under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), which requires appropriate hazardous communication labels and safety data sheets. In Europe, it is regulated under the REACH regulations, which cover the registration, evaluation, authorization, and restriction of chemicals. Additionally, it is classified by the FDA and EPA for environmental and toxicological safety, and may be subject to local and national regulations in different jurisdictions.

Are there alternatives to 4-Bromobenzoyl chloride (CAS: 586-75-4) in synthesis?

In synthesis, 4-Bromobenzoyl chloride (CAS: 586-75-4) can be substituted by other reagents like 4-chlorobenzoyl chloride or 4-fluorobenzoyl chloride. These alternatives may offer similar functionality but with different reactivity and toxicity profiles, allowing for flexibility in synthetic routes. Other options include using benzoyl chlorides with different substituents, such as 2-bromobenzoyl chloride or 3-bromobenzoyl chloride, depending on the specific requirements of the reaction.

What is the market or research trend for 4-Bromobenzoyl chloride (CAS: 586-75-4)?

The market for 4-Bromobenzoyl chloride (CAS: 586-75-4) and similar benzoyl chlorides continues to evolve, driven by advancements in organic synthesis and pharmaceutical research. There is an increasing interest in developing more efficient and environmentally friendly synthetic methods, which may lead to a shift towards less toxic reagents. Additionally, research trends are focusing on understanding the biological effects of these compounds, particularly in drug discovery and medicinal chemistry.

How should waste containing 4-Bromobenzoyl chloride (CAS: 586-75-4) be handled?

Waste containing 4-Bromobenzoyl chloride (CAS: 586-75-4) should be managed according to hazardous waste regulations. It should be collected in appropriate, labeled containers and disposed of through professional waste disposal services. Incineration may be a suitable method, but it must be conducted in an environmentally controlled incinerator. Environmental protection precautions, such as proper ventilation and personal protective equipment, should be strictly followed to prevent exposure and contamination. Compliance with local and national regulations is essential for safe waste disposal.