1-Chloro-3-methyl-2-butene

Basic Information

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CAS Number

503-60-6

Molecular Formula

C5H9Cl

Molecular Weight

104.58 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Boiling Point

109°C

Water Solubility

Miscible with chloroform, acetone, diethyl ether and alcohol. Immiscible with water.

Refractive Index

n20/D 1.4488(lit.)

SMILES

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CC(=CCCl)C

InChI

InChI=1S/C5H9Cl/c1-5(2)3-4-6/h3H,4H2,1-2H3

InChIKey

JKXQKGNGJVZKFA-UHFFFAOYSA-N

LogP

2.1914

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

Safety Information

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Hazard Statement

H225 Highly Flammable liquid and vapor
Flammable liquids

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class 3 Class 3

Synonyms & References

English

1-CHLORO-3-METHYL-2-BUTENE
1-chloro-3-methyl2-butene
D89386
3-methyl-but-2-enyl chloride
1-Chloro-3-methyl-2-butene (>85%)
EINECS 207-972-7
Prenyl chloride
SCHEMBL383294
3-methyl-1-chloro-2-butene
FT-0607621
gamma,gamma-Dimethylallyl chloride
CS-0204351
1-chloro-3-methyl-but-2-ene
3-Methyl-2-butenyl chloride
AKOS009031295
3,3-Dimethylallyl chloride
1-chloro3-methyl-2-butene
DTXSID7060120
W-105968
503-60-6
1-CHLORO-3-METHYL-2-BUTENE [HSDB]
4-Chloro-2-methyl-2-butene
1,1-DIMETHYL-3-CHLORO-1-PROPENE
prenylchloride
3-Methylcrotyl chloride
1-Chloro-3-methyl-2-butene (>85per cent)
.gamma.,.gamma.-Dimethylallyl chloride
InChI=1/C5H9Cl/c1-5(2)3-4-6/h3H,4H2,1-2H
F8881-2094
Q27282333
MFCD00000982

MDL Number

MFCD00000982

Customs Code

2903299090

FAQ

What regulatory guidelines apply to 1-Chloro-3-methyl-2-butene (CAS: 503-60-6)?

1-Chloro-3-methyl-2-butene (CAS: 503-60-6) falls under the classification of hazardous chemicals according to the GHS system. In the European Union, it is regulated under REACH, which requires manufacturers and importers to register substances if they are produced or imported in quantities of one tonne or more per year. The FDA and EPA may also have specific requirements for its use and disposal. Proper handling, packaging, and labeling are critical to comply with all relevant regulations.

Are there alternatives to 1-Chloro-3-methyl-2-butene (CAS: 503-60-6) in synthesis?

There are several alternatives to 1-Chloro-3-methyl-2-butene (CAS: 503-60-6) that can be used in synthesis. For example, 1-Bromo-3-methyl-2-butene can serve as a halide substitute. Additionally, other methods such as the use of acetylenic compounds or alkynes can be explored depending on the specific reaction requirements and desired product structure.

What is the market or research trend for 1-Chloro-3-methyl-2-butene (CAS: 503-60-6)?

The market for 1-Chloro-3-methyl-2-butene (CAS: 503-60-6) is primarily driven by its use in organic synthesis and as a precursor for various chemical intermediates. Research trends are focusing on exploring its applications in developing novel materials and pharmaceuticals. The demand is expected to grow with the increasing emphasis on sustainable and green chemistry processes.

How should waste containing 1-Chloro-3-methyl-2-butene (CAS: 503-60-6) be handled?

Waste containing 1-Chloro-3-methyl-2-butene (CAS: 503-60-6) should be collected in appropriate, leak-proof containers and stored separately. Proper disposal methods include incineration in a controlled environment or through professional waste disposal services. Environmental protection measures should include preventing the release of hazardous substances into the air or water to comply with environmental regulations.