2-Nitro-1-benzofuran

Basic Information

View in Editor

CAS Number

33094-66-5

Molecular Formula

C8H5NO3

Molecular Weight

163.13 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

134°C

Boiling Point

290.19°C (rough estimate)

Flash Point

118.995°C

Refractive Index

1.5160 (estimate)

SMILES

View in Editor

C1=CC=C2C(=C1)C=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C8H5NO3/c10-9(11)8-5-6-3-1-2-4-7(6)12-8/h1-5H

InChIKey

RSZMTXPFGDUHSE-UHFFFAOYSA-N

LogP

2.86420

Complexity

189

Synonyms & References

English

2-Nitro-benzofuran
4-17-00-00481 (Beilstein Handbook Reference)
AKOS006271665
MFCD00459786
NSC170697
AS-75753
BRN 0136254
R 5144
2-Nitrobenzofuran
A12428
33094-66-5
CS-0156003
17-hydroxypregn-4-ene-3,20-dione17-heptanoate
nitrobenzofuran
A875431
BENZOFURAN, 2-NITRO-
NSC 170697
NSC-170697
DTXSID80186750
2-nitro-1-benzofuran
SCHEMBL847484
CHEMBL7438
2-nitro-Benzofuran
Benzofuran, 2-nitro-
BENZOFURAN,2-NITRO

MDL Number

MFCD00459786

Customs Code

2932999099

FAQ

What regulatory guidelines apply to 2-Nitro-1-benzofuran (CAS: 33094-66-5)?

2-Nitro-1-benzofuran (CAS: 33094-66-5) is classified as a hazardous chemical under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS). It falls under the category of flammable solids and requires proper labeling. Additionally, it must comply with REACH regulations for registration, evaluation, authorization, and restriction of chemicals in the European Union. In the United States, it is regulated by the EPA under the Toxic Substances Control Act. FDA regulations may also apply if the compound is used in pharmaceutical or food applications.

Are there alternatives to 2-Nitro-1-benzofuran (CAS: 33094-66-5) in synthesis?

While 2-Nitro-1-benzofuran (CAS: 33094-66-5) is a specific compound, alternatives in synthesis could include other nitrobenzofurans or related heterocycles. Common alternatives might involve substituting the nitro group with other functional groups or using different benzofuran derivatives. These alternatives can vary based on the desired properties and reactivity in the synthesis process.

What is the market or research trend for 2-Nitro-1-benzofuran (CAS: 33094-66-5)?

The market for 2-Nitro-1-benzofuran (CAS: 33094-66-5) is relatively niche, primarily driven by its use in pharmaceuticals, agrochemicals, and research laboratories. Recent trends indicate increasing interest in its applications for medicinal chemistry, particularly in developing new drug candidates. Research is also exploring its use in organic synthesis as a synthetic intermediate. However, due to its hazardous nature, there is a growing emphasis on safer alternatives and sustainable processes.

How should waste containing 2-Nitro-1-benzofuran (CAS: 33094-66-5) be handled?

Waste containing 2-Nitro-1-benzofuran (CAS: 33094-66-5) should be collected in properly labeled containers and stored in a secure, well-ventilated area away from ignition sources. It must be disposed of according to local and international waste management regulations. For safe disposal, contact a licensed hazardous waste management company for incineration or professional waste disposal. Proper personal protective equipment (PPE) and safety measures are essential to prevent exposure and ensure environmental safety.