Methyl 3-amino-1H-thieno[3,2-c]pyrazole-5-carboxylate

Basic Information

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CAS Number

648411-35-2

Molecular Formula

C7H7N3O2S

Molecular Weight

197.22 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

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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COC(=O)C1=CC2=C(S1)C(=NN2)N

InChI

InChI=1S/C7H7N3O2S/c1-12-7(11)4-2-3-5(13-4)6(8)10-9-3/h2H,1H3,(H3,8,9,10)

InChIKey

BZTKCTZKSHFJDY-UHFFFAOYSA-N

LogP

0.9932

Topological Polar Surface Area

81.00000000000001 Å²

Hydrogen Bond Donor/Acceptor

3 / 5

Complexity

226

Synonyms & References

English

J-522123
F14469
AKOS006305282
DTXSID60659417
648411-35-2
1H-Thieno[3,2-c]pyrazole-5-carboxylic acid, 3-amino-, methyl ester
FT-0646429
3-amino-1H-thieno[3,2-c]pyrazole-5-carboxylic acid methyl ester
Methyl3-amino-1H-thieno[3,2-c]pyrazole-5-carboxylate
methyl 3-azanyl-1H-thieno[3,2-c]pyrazole-5-carboxylate
CS-0158921
SCHEMBL3881086
Methyl 3-amino-1H-thieno[3,2-c]pyrazole-5-carboxylate
1H-Thieno[3,2-c]pyrazole-5-carboxylicacid,3-amino-,methyl ester
A834896
BZTKCTZKSHFJDY-UHFFFAOYSA-N
AMY16132
1H-THIENO[3,2-C]PYRAZOLE-5-CARBOXYLIC ACID, 3-AMINO-, METHYL ESTER

MDL Number

MFCD10566753

Customs Code

2934999090

FAQ

What regulatory guidelines apply to Methyl 3-amino-1H-thieno[3,2-c]pyrazole-5-carboxylate (CAS: 648411-35-2)?

Methyl 3-amino-1H-thieno[3,2-c]pyrazole-5-carboxylate (CAS: 648411-35-2) is subject to regulatory guidelines under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations, and FDA/EPA requirements. GHS categorizes it based on its physical and health hazards, while REACH requires registration and evaluation of substances to ensure their safe use in the EU. FDA regulations may apply if it is used in food or pharmaceutical products, and EPA regulations might come into play if it is used in pesticide formulations.

Are there alternatives to Methyl 3-amino-1H-thieno[3,2-c]pyrazole-5-carboxylate in synthesis?

Several alternatives can be considered in the synthesis of Methyl 3-amino-1H-thieno[3,2-c]pyrazole-5-carboxylate, including thienopyrazole derivatives with different substituents. Analogous compounds such as methyl 3-chloro-1H-thieno[3,2-c]pyrazole-5-carboxylate or methyl 3-ethyl-1H-thieno[3,2-c]pyrazole-5-carboxylate can serve as alternatives. Common alternative reagents might include different amine or thiazole derivatives, which can provide similar functional groups and properties.

What is the market or research trend for Methyl 3-amino-1H-thieno[3,2-c]pyrazole-5-carboxylate (CAS: 648411-35-2)?

The market for Methyl 3-amino-1H-thieno[3,2-c]pyrazole-5-carboxylate (CAS: 648411-35-2) is currently showing growing interest due to its potential applications in pharmaceuticals, specifically as an intermediate in the synthesis of antiviral and antifungal agents. Research trends are focusing on its biological activity and structural modifications to enhance its efficacy and reduce side effects. Additionally, its use in agrochemicals as a herbicide or fungicide is also being explored.

How should waste containing Methyl 3-amino-1H-thieno[3,2-c]pyrazole-5-carboxylate (CAS: 648411-35-2) be handled?

Waste containing Methyl 3-amino-1H-thieno[3,2-c]pyrazole-5-carboxylate (CAS: 648411-35-2) should be collected and handled according to local and national regulations. Incineration is a common method for disposal, but it must be conducted in a professional incineration facility to ensure proper destruction. Alternatively, chemical precipitation or neutralization can be used to minimize the waste's environmental impact. Environmental protection precautions include minimizing the release of contaminants into water and air during handling and disposal, and proper labeling and documentation of waste management activities.