5-Nitro-1H-indazole-3-carbonitrile

Basic Information

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CAS Number

90348-29-1

Molecular Formula

C8H4N4O2

Molecular Weight

17.03 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

SMILES

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C1=CC2=C(C=C1[N+](=O)[O-])C(=NN2)C#N

InChI

InChI=1S/C8H4N4O2/c9-4-8-6-3-5(12(13)14)1-2-7(6)10-11-8/h1-3H,(H,10,11)

InChIKey

WXTZAAHDBOKXDI-UHFFFAOYSA-N

LogP

0.16199999999999998

Topological Polar Surface Area

35.0 Å²

Hydrogen Bond Donor/Acceptor

3 / 1

Complexity

292

Synonyms & References

English

5-Nitro-1H-indazole-3-carbonitrile
5-Nitro-1H-indazole-3-carbonitrile (ACI)
3-Cyano-5-nitro-1H-indazole
5-nitro-1H-indazole-3-carbonitrile
5-Nitro-2H-indazole-3-carbonitrile
90348-29-1
G11820
WXTZAAHDBOKXDI-UHFFFAOYSA-N
SCHEMBL3135230
SB39754
MFCD09701265
1H-Indazole-3-carbonitrile, 5-nitro-
5-NITRO-1H-INDAZOLE-3-CARBONITRILE
DB-078652
AKOS006331275
AS-61926
DTXSID20626544

MDL Number

MFCD09701265

FAQ

What regulatory guidelines apply to 5-Nitro-1H-indazole-3-carbonitrile (CAS: 90348-29-1)?

5-Nitro-1H-indazole-3-carbonitrile (CAS: 90348-29-1) is subject to the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations in the European Union, and FDA/EPA guidelines for the United States. Manufacturers and distributors must comply with these regulations for handling, storage, and transportation to ensure safety and environmental protection.

Are there alternatives to 5-Nitro-1H-indazole-3-carbonitrile in synthesis?

There are several alternatives to 5-Nitro-1H-indazole-3-carbonitrile in synthesis. Common alternatives include 4-Nitro-1H-indazole-3-carbonitrile and 3-Nitro-1H-indazole-5-carbonitrile. These compounds can be used as substitutes depending on the specific needs of the synthesis process.

What is the market or research trend for 5-Nitro-1H-indazole-3-carbonitrile (CAS: 90348-29-1)?

The market for 5-Nitro-1H-indazole-3-carbonitrile (CAS: 90348-29-1) is growing due to its applications in pharmaceuticals and agrochemicals. Research trends indicate increasing interest in its use as an intermediate in the development of new drug candidates and pesticides. The trend is also influenced by regulatory changes and environmental concerns.

How should waste containing 5-Nitro-1H-indazole-3-carbonitrile (CAS: 90348-29-1) be handled?

Waste containing 5-Nitro-1H-indazole-3-carbonitrile (CAS: 90348-29-1) should be collected in appropriate containers and disposed of through professional waste disposal services. Incineration is a common method for handling this waste, and environmental protection measures should be strictly followed to prevent contamination. Proper labeling and documentation of waste management procedures are essential.