3-Bromopropanoyl chloride

Basic Information

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CAS Number

15486-96-1

Molecular Formula

C3H4BrClO

Molecular Weight

171.42 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Water Treatment Chemicals Coagulants and Flocculants Inorganic Coagulants

Water Treatment Chemicals Disinfectants Chlorine Compounds

Basic Physical Properties

Boiling Point

55-57 °C/17 mmHg

Refractive Index

n20/D 1.49(lit.)

SMILES

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C(CBr)C(=O)Cl

InChI

InChI=1S/C3H4BrClO/c4-2-1-3(5)6/h1-2H2

InChIKey

IHBVNSPHKMCPST-UHFFFAOYSA-N

LogP

1.5368

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

54.8

Safety Information

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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

Sensitiveness

Moisture Sensitive

Synonyms & References

English

3-Bromopropionyl chloride, technical grade
3-bromopropanoylchloride
D88890
BCP20557
3-Bromopropionylchloride
3-bromo-propionyl chloride
EINECS 239-515-2
VS-02968
3-bromopropionic acid chloride
Propanoyl chloride, 3-bromo-
3-bromanylpropanoyl chloride
SCHEMBL34044
AKOS005720747
3-bromopropionic chloride
AM90184
SY035526
DTXSID3065900
B2065
.beta.-Bromopropionyl chloride
EN300-132996
3-bromo propionylchloride
NS00025032
3-Bromopropanoyl chloride #
3-bromoproionylchloride
MFCD00000746
beta-Bromopropionyl chloride
3-bromo-propanoyl chloride
W-108026
15486-96-1
3-Bromopropionyl chloride
A809580

MDL Number

MFCD00000746

Customs Code

2915900090

FAQ

What are the physical and chemical properties of 3-Bromopropanoyl chloride (CAS: 15486-96-1)?

3-Bromopropanoyl chloride (CAS: 15486-96-1) is a colorless to slightly yellow fuming liquid with a molecular weight of approximately 173.02 g/mol. It has a high vapor pressure and is poorly soluble in water but miscible with most organic solvents. It is highly reactive, particularly with amines and alcohols, and is used in organic synthesis as a brominating agent.

How is 3-Bromopropanoyl chloride (CAS: 15486-96-1) typically synthesized?

3-Bromopropanoyl chloride (CAS: 15486-96-1) is synthesized by reacting propanoyl chloride with bromine. The reaction is typically conducted in a suitable solvent like methylene chloride under ice-cooling to control the reaction rate and ensure high selectivity. The yield of the product is typically around 80-85%, with the use of a phase transfer catalyst enhancing the reaction efficiency.

What industries use 3-Bromopropanoyl chloride (CAS: 15486-96-1)?

3-Bromopropanoyl chloride (CAS: 15486-96-1) is used in various industries, including pharmaceuticals, where it serves as a brominating agent in the synthesis of drug precursors. It is also used in the production of organic compounds, polymers, and sensors. Its use in semiconductor manufacturing processes for specific chemical treatments is also notable.

What precautions should be taken when handling 3-Bromopropanoyl chloride (CAS: 15486-96-1)?

When handling 3-Bromopropanoyl chloride (CAS: 15486-96-1), it is crucial to use personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated fume hood to avoid inhalation of the vapors. Spills should be cleaned up with appropriate absorbents and proper disposal procedures followed. Safety data sheets (SDS) should be consulted for detailed safety instructions and emergency response measures.