3-Bromooxetane

Basic Information

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CAS Number

39267-79-3

Molecular Formula

C3H5BrO

Molecular Weight

136.98 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Water Treatment Chemicals Disinfectants Chlorine Compounds

Basic Physical Properties

Boiling Point

126°C

Refractive Index

n20/D 1.484

SMILES

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BrC1COC1

InChI

InChI=1S/C3H5BrO/c4-3-1-5-2-3/h3H,1-2H2

InChIKey

SZTIZZFKWQWSSP-UHFFFAOYSA-N

LogP

0.7801

Topological Polar Surface Area

9.23 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

33.9

Safety Information

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Hazard Statement

H226 Flammable liquid and vapor
Flammable liquids

H302 Harmful if swallowed
Acute toxicity, oral

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class 3 Class 3

Synonyms & References

English

3-Bromooxetane
3-BROMO-OXETANE
2-Bromo-1,3-epoxypropane
3-bromo oxetane
3-bromanyloxetane
AMOT00006
SZTIZZFKWQWSSP-UHFFFAOYSA-N
HT173
BCP25454
BBL102563
STL556366
RP08138
PB32639
ST1020090
AB0037765
Y5092
BB 0261956
AM20020035
4C
3-bromooxetane

MDL Number

MFCD08544402

Customs Code

2932999099

FAQ

What are the physical and chemical properties of 3-Bromooxetane (CAS: 39267-79-3)?

3-Bromooxetane (CAS: 39267-79-3) is a colorless liquid with a molecular weight of 119.01. It has a low boiling point, melting point around -91°C, and is slightly soluble in water. It is highly reactive towards nucleophiles and can undergo various substitution reactions. It is often used in organic synthesis for the introduction of a bromine substituent.

How is 3-Bromooxetane (CAS: 39267-79-3) typically synthesized?

3-Bromooxetane (CAS: 39267-79-3) is usually synthesized via the bromination of oxetane. The reaction is typically catalyzed by a Lewis acid such as aluminum chloride, providing good yield and selectivity. The process is conducted under mild conditions to avoid side reactions.

What industries use 3-Bromooxetane (CAS: 39267-79-3)?

3-Bromooxetane (CAS: 39267-79-3) is primarily used in the pharmaceutical and polymer industries. It serves as a versatile reagent for the introduction of bromine in organic syntheses, contributing to the development of new drugs and materials. Its use in sensors and other specialized applications is also growing due to its reactivity.

What precautions should be taken when handling 3-Bromooxetane (CAS: 39267-79-3)?

When handling 3-Bromooxetane (CAS: 39267-79-3), it is essential to wear appropriate personal protective equipment such as gloves and safety glasses. It should be stored in a cool, well-ventilated area, away from sources of heat. In case of a spill, use appropriate containment and disposal methods as per the Material Safety Data Sheet (MSDS).