2,4-Dibromobutanoyl chloride

Basic Information

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CAS Number

82820-87-9

Molecular Formula

C4H5Br2ClO

Molecular Weight

264.34 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Water Treatment Chemicals Coagulants and Flocculants Inorganic Coagulants

Basic Physical Properties

Density

2.00 g/mL at 20 °C

Refractive Index

n20/D 1.535

SMILES

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C(CBr)C(C(=O)Cl)Br

InChI

InChI=1S/C4H5Br2ClO/c5-2-1-3(6)4(7)8/h3H,1-2H2

InChIKey

WYZLYWUZERABRL-UHFFFAOYSA-N

LogP

2.3003

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

86.1

Safety Information

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Hazard Statement

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

H317 May cause an allergic skin reaction
Sensitization, Skin

H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled
Sensitization, respiratory

Synonyms & References

English

D87595
MFCD01862994
2,4 dibromobutanoyl chloride
BrCH2CH2CH(Br)C(O)Cl
2,4-Dibromobutyryl chloride, technical, ~90% (GC)
MS-20607
82820-87-9
FT-0722142
2,4-dibromobutanoic acid chloride
WYZLYWUZERABRL-UHFFFAOYSA-N
2,4-dibromobutyric acid chloride
2,4-dibromobutanoyl chloride
SCHEMBL789095
AKOS015898911
AM20080598
2,4dibromobutyryl chloride
2,4-dibromo-butyryl chloride
2,4-Dibromobutyryl chloride
Butanoyl chloride, 2,4-dibromo-
DTXSID50403002
2,4-dibromobutyrylchloride
2,4-Dibromobutanoyl chloride
Butanoyl chloride,2,4-dibromo
2,4-Dibromobutanoylchloride

MDL Number

MFCD01862994

Customs Code

2915900090

FAQ

What regulatory guidelines apply to 2,4-Dibromobutanoyl chloride (CAS: 82820-87-9)?

2,4-Dibromobutanoyl chloride (CAS: 82820-87-9) falls under the Chemicals of Very High Concern (SVHC) list as per REACH regulations in the European Union. It is classified as a Hazardous Substance in the Globally Harmonized System (GHS) and requires proper labeling and safety data sheets. The FDA and EPA have specific guidelines for the handling and disposal of this compound to prevent environmental contamination and ensure worker safety.

Are there alternatives to 2,4-Dibromobutanoyl chloride (CAS: 82820-87-9) in synthesis?

For the synthesis of derivatives or similar functional groups, alternative reagents such as 2-bromobutanoic acid or 2-bromobutane can be used. Isomers like 2,3-dibromobutanoyl chloride may also serve as viable alternatives. However, the choice depends on the specific reaction conditions and desired product profile.

What is the market or research trend for 2,4-Dibromobutanoyl chloride (CAS: 82820-87-9)?

The market for 2,4-Dibromobutanoyl chloride (CAS: 82820-87-9) is primarily driven by its use in pharmaceuticals and agrochemicals. Recent research trends focus on developing safer alternatives and exploring its role in novel drug discovery processes. Market demand is expected to grow due to increasing R&D activities in these sectors.

How should waste containing 2,4-Dibromobutanoyl chloride (CAS: 82820-87-9) be handled?

Waste containing 2,4-Dibromobutanoyl chloride (CAS: 82820-87-9) should be collected in appropriate containers lined with liners. Incineration is a suitable method for disposal, but professional waste disposal services should be utilized to ensure compliance with environmental regulations. Proper environmental protection measures, including containment and disposal, are crucial to prevent environmental contamination.