1-Ethynyl-4-heptylbenzene

Basic Information

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CAS Number

79887-12-0

Molecular Formula

C15H20

Molecular Weight

190.33 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Physical Properties

SMILES

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CCCCCCCC1=CC=C(C=C1)C#C

InChI

InChI=1S/C15H20/c1-3-5-6-7-8-9-15-12-10-14(4-2)11-13-15/h2,10-13H,3,5-9H2,1H3

InChIKey

CFWOIXKFXVUJPA-UHFFFAOYSA-N

LogP

4.507920000000004

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

187

Synonyms & References

English

AMY1611
1-ethynyl-4-heptyl-benzene
79887-12-0
AB91831
FT-0607766
CS-0455912
4-heptylphenylacetylene
DTXSID00379400
J-504619
MFCD00173882
1-ethynyl-4-heptylbenzene
AKOS015890845
1-Ethynyl-4-heptylbenzene
4-N-HEPTYLPHENYLACETYLENE
p-n-heptylphenylacetylene

MDL Number

MFCD00173882

Customs Code

2902909090

FAQ

What regulatory guidelines apply to 1-Ethynyl-4-heptylbenzene (CAS: 79887-12-0)?

1-Ethynyl-4-heptylbenzene (CAS: 79887-12-0) is subject to the Global Harmonized System of Classification and Labeling of Chemicals (GHS), REACH regulations, and FDA/EPA guidelines. Manufacturers and users must comply with these regulations for proper labeling, storage, and handling to ensure workplace safety and environmental protection.

Are there alternatives to 1-Ethynyl-4-heptylbenzene (CAS: 79887-12-0) in synthesis?

While 1-Ethynyl-4-heptylbenzene (CAS: 79887-12-0) is a specific compound, there are alternative reagents and isomers that can be used in synthesis. For example, 1-Ethynyl-3-heptylbenzene and other similar compounds may serve as viable alternatives depending on the specific application requirements.

What is the market or research trend for 1-Ethynyl-4-heptylbenzene (CAS: 79887-12-0)?

The market for 1-Ethynyl-4-heptylbenzene (CAS: 79887-12-0) is driven by its use in various industries, including pharmaceuticals and materials science. Research trends indicate growing interest in its potential applications in new drug development and advanced materials. However, the market dynamics can be influenced by changes in regulatory requirements and pricing trends.

How should waste containing 1-Ethynyl-4-heptylbenzene (CAS: 79887-12-0) be handled?

Waste containing 1-Ethynyl-4-heptylbenzene (CAS: 79887-12-0) should be collected in appropriate containers and disposed of through incineration or professional waste disposal services. Proper environmental protection measures should be followed to minimize risks to human health and the environment. Compliance with local waste management regulations is essential.