2-(Chloromethyl)tetrahydrofuran

Basic Information

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CAS Number

3003-84-7

Molecular Formula

C5H9ClO

Molecular Weight

120.58 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

Basic Physical Properties

Boiling Point

151°C

Solubility

Not miscible or difficult to mix.

Refractive Index

n20/D 1.455(lit.)<br />n20/D 1.456

SMILES

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C1CC(OC1)CCl

InChI

InChI=1S/C5H9ClO/c6-4-5-2-1-3-7-5/h5H,1-4H2

InChIKey

IVJLGIMHHWKRAN-UHFFFAOYSA-N

LogP

1.4042

Topological Polar Surface Area

9.23 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

Safety Information

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GHS Hazard Pictograms

H226

H315

H319

H335

Hazard Statement

H226 Flammable liquid and vapor
Flammable liquids

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

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

Hazard Class

Class 3 Class 3

Sensitiveness

Moisture Sensitive

Synonyms & References

English

DTXSID40883930
SCHEMBL1430397
InChI=1/C5H9ClO/c6-4-5-2-1-3-7-5/h5H,1-4H2
AI3-17421
R874RQ16IG
MFCD00005370
AKOS016039395
2-Chloromethyltetrahydrofuran
5-17-01-00079 (Beilstein Handbook Reference)
HMS1408L08
Q27287958
Tetrahydrofurfuryl chloride, >=97.0% (GC)
EINECS 221-102-3
Tetrahydrofurfuryl chloride
2-CHLOROMETHYL TETRAHYDROFURAN [HSDB]
Z56893271
2-(Chloromethyl)tetrahydrofuran
J-802293
AKOS000120695
NSC2874
3003-84-7
AC-25685
F0001-0927
2-(chloromethyl)-tetrahydro-furan
2-chloromethyl-tetrahydro-furan
SY049357
T0800
2-CHLOROMETHYL TETRAHYDROFURAN
IDI1_007765
D78464
2-(Chloromethyl)oxolane

MDL Number

MFCD00005370

Customs Code

29321900

FAQ

What are the physical and chemical properties of 2-(Chloromethyl)tetrahydrofuran (CAS: 3003-84-7)?

2-(Chloromethyl)tetrahydrofuran is a colorless liquid at room temperature. Its molecular weight is approximately 126.02 g/mol. It is slightly soluble in water but miscible with common organic solvents like ethanol and ether. This compound is known for its reactivity, particularly towards nucleophiles and elimination reactions.

How is 2-(Chloromethyl)tetrahydrofuran (CAS: 3003-84-7) typically synthesized?

2-(Chloromethyl)tetrahydrofuran is usually synthesized through the reaction of 1,4-dioxane with chloroform in the presence of a base. The reaction proceeds through an SN2 mechanism, yielding a high yield of the desired product. Sodium hydride is often used as a base in this synthesis.

What industries use 2-(Chloromethyl)tetrahydrofuran (CAS: 3003-84-7)?

2-(Chloromethyl)tetrahydrofuran is used in various industries, including pharmaceuticals for intermediate synthesis, polymers for functionalization, and sensors for detection purposes. It is also employed in semiconductor manufacturing for cleaning and etching processes.

What precautions should be taken when handling 2-(Chloromethyl)tetrahydrofuran (CAS: 3003-84-7)?

When handling 2-(Chloromethyl)tetrahydrofuran, it is crucial to use appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The compound should be stored in a fume hood to minimize exposure to fumes. In case of spills, it is important to follow the emergency spill response procedure outlined in the safety data sheet (SDS).