1-Bromo-2-octyne

Basic Information

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CAS Number

18495-27-7

Molecular Formula

C8H13Br

Molecular Weight

86.18 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Physical Properties

Boiling Point

64°C 20mm

Refractive Index

1.4883

SMILES

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CCCCCC#CCBr

InChI

InChI=1S/C8H13Br/c1-2-3-4-5-6-7-8-9/h2-5,8H2,1H3

InChIKey

QKPBYOBXEXNWOA-UHFFFAOYSA-N

LogP

2.5866000000000007

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

104

Synonyms & References

English

QKPBYOBXEXNWOA-UHFFFAOYSA-N
D94830
FT-0637705
DTXSID20373728
MFCD00190196
1-bromooct-2-yne
CS-0152339
SCHEMBL1873508
18495-27-7
AKOS006343944
FS-4715
A812902
2-Octyne,1-bromo-
1-Bromo-2-octyne
2-Octyne, 1-bromo-
EN300-7606135
1-Brom-2-octin
2-octynyl bromide
1-Bromo-2-Octyne
1-bromanyloct-2-yne
1-bromooct-2-ene
1-bromo-oct-2-yne
2-Octyne,1-bromo
oct-2-ynyl-bromide
TIMTEC-BB SBB008836
1-BROMO-2-OCTYNE 96%

MDL Number

MFCD00190196

Customs Code

2903399090

FAQ

What regulatory guidelines apply to 1-Bromo-2-octyne (CAS: 18495-27-7)?

Regulatory guidelines for 1-Bromo-2-octyne (CAS: 18495-27-7) include the GHS classification, which categorizes it as an environmentally hazardous substance. In the European Union, it is regulated under REACH, requiring registration if manufactured or imported in quantities exceeding 1 tonne annually. The FDA and EPA have specific regulatory requirements for its use in pharmaceutical and agricultural applications, respectively, including reporting, labeling, and environmental management.

Are there alternatives to 1-Bromo-2-octyne (CAS: 18495-27-7) in synthesis?

Alternatives to 1-Bromo-2-octyne (CAS: 18495-27-7) in synthesis include 1-bromo-2-heptyne and 1-bromo-2-decene. These can serve as substitutes depending on the desired functionality. Other common reagents such as 1-bromo-2-methylbutyne and 1-bromo-2-butyne are also frequently used as precursors in organic synthesis, providing similar reactivity for various applications.

What is the market or research trend for 1-Bromo-2-octyne (CAS: 18495-27-7)?

The market for 1-Bromo-2-octyne (CAS: 18495-27-7) is driven by its use in the synthesis of pharmaceuticals and agrochemicals, with ongoing research focusing on its potential in polymer chemistry. Recent trends indicate increasing interest in biodegradable polymers, where 1-Bromo-2-octyne plays a crucial role as a monomer. Additionally, there is a growing focus on sustainable and eco-friendly alternatives in the chemical industry, which may influence market dynamics in the future.

How should waste containing 1-Bromo-2-octyne (CAS: 18495-27-7) be handled?

Waste containing 1-Bromo-2-octyne (CAS: 18495-27-7) should be collected in sealed, well-labeled containers and disposed of through a professional hazardous waste disposal service. Incineration is a common method for handling such waste, ensuring complete destruction and minimizing environmental impact. Environmental protection measures include proper containment to prevent spillage and the use of appropriate personal protective equipment (PPE) during handling and disposal.