5-methoxy-1H-indazole-3-carbonitrile

Basic Information

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CAS Number

90322-88-6

Molecular Formula

C9H7N3O

Molecular Weight

17.03 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

SMILES

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COC1=CC2=C(C=C1)NN=C2C#N

InChI

InChI=1S/C9H7N3O/c1-13-6-2-3-8-7(4-6)9(5-10)12-11-8/h2-4H,1H3,(H,11,12)

InChIKey

XXCNXBQYSICCPC-UHFFFAOYSA-N

LogP

0.16199999999999998

Topological Polar Surface Area

35.0 Å²

Hydrogen Bond Donor/Acceptor

3 / 1

Complexity

234

Synonyms & References

English

5-methoxy-1H-indazole-3-carbonitrile
3-CYANO-5-METHOXY-1H-INDAZOLE
3-Cyano-5-methoxy (1H)indazole
5-methoxy-1(2)H-indazole-3-carbonitrile
5-Methoxy-indazol-3-carbonitril
5-Methoxy-1H-indazole-3-carbonitrile (ACI)
90322-88-6
DB-078650
DTXSID40659470
MFCD09834654
SCHEMBL17221540
XXCNXBQYSICCPC-UHFFFAOYSA-N
AKOS006328525
CS-0340876
3-Cyano-5-methoxy-1H-indazole
AB52766

MDL Number

MFCD09834654

Customs Code

2933990090

FAQ

What regulatory guidelines apply to 5-methoxy-1H-indazole-3-carbonitrile (CAS: 90322-88-6)?

5-Methoxy-1H-indazole-3-carbonitrile (CAS: 90322-88-6) must comply with various regulatory guidelines including GHS classification for hazardous chemicals, REACH regulations in the European Union, and FDA/EPA requirements for import and use. Specific handling, storage, and disposal procedures are outlined in these guidelines to ensure worker safety and environmental protection.

Are there alternatives to 5-methoxy-1H-indazole-3-carbonitrile (CAS: 90322-88-6) in synthesis?

There are several alternatives to 5-methoxy-1H-indazole-3-carbonitrile (CAS: 90322-88-6) in synthesis, including other indazole derivatives such as 1H-indazole-3-carbonitrile and 5-methoxy-1H-indazole. These can serve as effective alternatives depending on the specific reaction conditions and desired product properties.

What is the market or research trend for 5-methoxy-1H-indazole-3-carbonitrile (CAS: 90322-88-6)?

The market and research trends for 5-methoxy-1H-indazole-3-carbonitrile (CAS: 90322-88-6) are focused on its applications in pharmaceuticals, particularly as an intermediate in the synthesis of drugs targeting various diseases. Research is also exploring its potential in materials science and as a precursor for other chemical compounds.

How should waste containing 5-methoxy-1H-indazole-3-carbonitrile (CAS: 90322-88-6) be handled?

Waste containing 5-methoxy-1H-indazole-3-carbonitrile (CAS: 90322-88-6) should be collected in appropriate containers and managed according to local hazardous waste regulations. Professional waste disposal services are recommended, and incineration or chemical conversion methods can be used to ensure safe disposal. Environmental protection measures, such as minimizing spillage and properly labeling containers, are crucial.