4-(Chloromethyl)benzoyl chloride

Basic Information

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CAS Number

876-08-4

Molecular Formula

C8H6Cl2O

Molecular Weight

189.04 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

30-32 °C

Boiling Point

126-128 °C/6 mmHg

Density

1.2979 (rough estimate)

Refractive Index

1.5772

SMILES

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C1=CC(=CC=C1CCl)C(=O)Cl

InChI

InChI=1S/C8H6Cl2O/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,5H2

InChIKey

RCOVTJVRTZGSBP-UHFFFAOYSA-N

LogP

2.804400000000001

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

139

Safety Information

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GHS Hazard Pictograms

H314

H335

Hazard Statement

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

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

Hazard Class

Class 8 Class 8

Synonyms & References

English

4-(Chloromethyl)benzoyl chloride
Benzoyl chloride,4-(chloromethyl)-
4-chloromethyl-benzoyl chloride
p-chloromethyl-benzoyl chloride
p-Toluoylchloride, a-chloro- (6CI,7CI,8CI)
NSC 508741
p-(Chloromethyl)benzoyl chloride
a-Chloro-p-toluoyl chloride
Benzoyl chloride, 4-(chloromethyl)-
4-chloromethylbenzoyl chloride
4-(Chloromethyl)benzoylchloride
4-chloromethylbenzoylchloride
4-chloromethyl benzoyl chloride
NSC508741
4-chlormethylbenzoylchloride
4-(chlormethyl)benzoylchlorid
p-chloromethylbenzoyl chloride
KSC491C5T
4-chloromethyl-benzoylchloride
p-chloromethyl benzoyl chloride
4-(Chloromethyl)benzoyl chloride (ACI)
p-Toluoyl chloride, α-chloro- (6CI, 7CI, 8CI)
α-Chloro-p-toluoyl chloride
944K6CA5WU
NSC-508741
DTXSID20236501
ALPHA-CHLORO-P-TOLUOYL CHLORIDE
4-(Chloromethyl)benzoyl chloride, 97%
4-(chloromethyl)-benzoyl chloride
876-08-4
EINECS 212-881-0

MDL Number

MFCD00053224

Customs Code

2916399090

FAQ

What is 4-(Chloromethyl)benzoyl chloride (CAS: 876-08-4)?

4-(Chloromethyl)benzoyl chloride (CAS: 876-08-4) is an organic compound with the chemical formula C8H6Cl2O. It is a colorless liquid known for its reactive nature and is commonly used as an intermediate in chemical synthesis. The compound features a benzoyl chloride group attached to a chloromethyl substituent on the benzene ring, making it valuable in pharmaceutical and industrial applications.

What are the main uses of 4-(Chloromethyl)benzoyl chloride (CAS: 876-08-4)?

4-(Chloromethyl)benzoyl chloride (CAS: 876-08-4) is primarily used in pharmaceuticals for synthesizing drugs and bioactive compounds. It also serves as an industrial reagent in the production of dyes, pesticides, and polymers. In research settings, it acts as a key intermediate for creating complex organic molecules. Its unique chemical structure makes it suitable for applications requiring chloromethyl and benzoyl functionality.

Is 4-(Chloromethyl)benzoyl chloride (CAS: 876-08-4) safe?

4-(Chloromethyl)benzoyl chloride (CAS: 876-08-4) requires careful handling due to its potential toxicity and reactivity. Inhalation or skin contact may cause irritation, and it is flammable. Safety measures include using appropriate personal protective equipment (PPE), working in a well-ventilated area, and following OSHA and EPA guidelines. Always prioritize safety protocols when handling this compound.

How should 4-(Chloromethyl)benzoyl chloride (CAS: 876-08-4) be stored?

4-(Chloromethyl)benzoyl chloride (CAS: 876-08-4) should be stored in a cool, dry, and well-ventilated area, away from light. Keep it in a tightly sealed container made of materials resistant to chemical reactions, such as glass or stainless steel. Maintain storage conditions below 25°C and ensure humidity levels are low to preserve stability. Store in a fume hood to minimize exposure risks.