6-Bromohexanoyl chloride

Basic Information

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CAS Number

22809-37-6

Molecular Formula

C6H10BrClO

Molecular Weight

213.5 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Physical Properties

Boiling Point

130 °C/20 mmHg

Refractive Index

n20/D 1.486(lit.)

SMILES

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C(CCC(=O)Cl)CCBr

InChI

InChI=1S/C6H10BrClO/c7-5-3-1-2-4-6(8)9/h1-5H2

InChIKey

HBPVGJGBRWIVSX-UHFFFAOYSA-N

LogP

2.7071000000000014

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

85.1

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

bromohexanoyl chloride
J-014863
FS-4777
NS00027266
6-bromanylhexanoyl chloride
6-bromohexanoic chloride
SY017885
6-Bromohexanoyl chloride, 97%
22809-37-6
6-Bromohexanoylchloride
6YI1QB4VWJ
6-BROMOCAPROIC CHLORIDE
B2049
.OMEGA.-BROMOHEXANOYL CHLORIDE
MFCD00000761
EINECS 245-236-7
D88888
UNII-6YI1QB4VWJ
6-bromo-hexanoylchloride
DTXSID5066829
.EPSILON.-BROMOCAPROYL CHLORIDE
FT-0620998
SCHEMBL34211
AMY14557
6-Bromocaproyl chloride
A816369
6-bromo-hexanoyl chloride
AKOS015916287
6-Bromohexanoic acid chloride
HBPVGJGBRWIVSX-UHFFFAOYSA-
BP-31242

MDL Number

MFCD00000761

Customs Code

29159080

FAQ

What are the physical and chemical properties of 6-Bromohexanoyl chloride (CAS: 22809-37-6)?

6-Bromohexanoyl chloride (CAS: 22809-37-6) is a white crystalline solid with a molecular weight of approximately 249.04 g/mol. It has low solubility in water but is soluble in organic solvents like ethanol and acetone. This compound exhibits strong reactivity due to the presence of the electrophilic chlorine and bromine groups, making it suitable for various synthetic applications.

How is 6-Bromohexanoyl chloride (CAS: 22809-37-6) typically synthesized?

6-Bromohexanoyl chloride can be synthesized through the reaction of hexanoic acid with bromine in the presence of thionyl chloride as a catalyst. This process yields a high yield of the desired product with good selectivity. The reaction conditions are optimized to achieve a balanced reactivity and minimize side reactions.

What industries use 6-Bromohexanoyl chloride (CAS: 22809-37-6)?

6-Bromohexanoyl chloride (CAS: 22809-37-6) is used in pharmaceuticals for the synthesis of intermediates, in polymers for functionalization, and in the manufacturing of sensors and semiconductors for doping purposes. Its versatile reactivity and functional groups make it a valuable reagent in these industries.

What precautions should be taken when handling 6-Bromohexanoyl chloride (CAS: 22809-37-6)?

When handling 6-Bromohexanoyl chloride (CAS: 22809-37-6), it is essential to wear appropriate personal protective equipment (PPE) including gloves, safety glasses, and a lab coat. Work must be conducted in a well-ventilated area or a fume hood to avoid inhalation. Spills should be cleaned up using appropriate absorbents, and proper disposal methods should be followed. Always consult the Safety Data Sheet (SDS) for detailed handling and disposal guidelines.