[4-Methoxy-7-(3-methyl-1H-1,2,4-triazol-1-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl](oxo)acetic acid

Basic Information

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CAS Number

676491-47-7

Molecular Formula

C13H11N5O4

Molecular Weight

301.26 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

SMILES

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Cc1ncn(n1)c2c3c(c(c[nH]3)C(=O)C(=O)O)c(cn2)OC

InChI

InChI=1S/C13H11N5O4/c1-6-16-5-18(17-6)12-10-9(8(22-2)4-15-12)7(3-14-10)11(19)13(20)21/h3-5,14H,1-2H3,(H,20,21)

InChIKey

GQHBPAXZVTUKID-UHFFFAOYSA-N

LogP

0.7279199999999998

Topological Polar Surface Area

122.99000000000001 Å²

Hydrogen Bond Donor/Acceptor

2 / 9

Complexity

462

Synonyms & References

English

[4-Methoxy-7-(3-methyl-1H-1,2,4-triazol-1-yl)-1H-pyrrolo[2,3-c]py ridin-3-yl](oxo)acetic acid
CTK8B3528
4-Methoxy-3-nitrophenylboronic acid pinacol ester
1,3,2-DIOXABOROLANE, 2-(4-METHOXY-3-NITROPHENYL)-4,4,5,5-TETRAMETHYL-
SureCN4771663
4-methoxy-7-(3-methyl-1,2,4-triazol-1-yl)-6-azaindol-3-yl-oxoacetic acid
2-(4-methoxy-3-nitro-phenyl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane
2-(4-methoxy-3-nitrophenyl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane
BM322
2-(4-methoxy-7-(3 -methyl-1H-1,2,4-triazol-1-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl)-2-oxoacetic acid
AGN-PC-01LR1M
1H-Pyrrolo[2,3-c]pyridine-3-acetic acid, 4-Methoxy-7-(3-Methyl-1H-1,2,4-triazol-1-yl)-α-oxo-
2-(4-methoxy-7-(3-methyl-1H-1,2,4-triazol-1-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl)-2-oxoacetic acid
GQHBPAXZVTUKID-UHFFFAOYSA-N

MDL Number

MFCD20526542

FAQ

What are the physical and chemical properties of (4-Methoxy-7-(3-methyl-1H-1,2,4-triazol-1-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl)(oxo)acetic acid (CAS: 676491-47-7)?

This compound is a solid with a crystalline form. It has a molecular weight of approximately 389.34 g/mol. It shows low water solubility. Reactivity is moderate, with limited reactivity towards common nucleophiles and bases. It is stable under normal conditions but may degrade under strong acidic or basic conditions.

How is (4-Methoxy-7-(3-methyl-1H-1,2,4-triazol-1-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl)(oxo)acetic acid (CAS: 676491-47-7) typically synthesized?

This compound can be synthesized via multistep processes involving the coupling of a pyrrolopyridine derivative with 3-methyl-1H-1,2,4-triazole, followed by acetylation. Commonly used catalysts include palladium-based catalysts. The process yields a selective product with good to excellent yield.

What industries use (4-Methoxy-7-(3-methyl-1H-1,2,4-triazol-1-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl)(oxo)acetic acid (CAS: 676491-47-7)?

This compound is used in the pharmaceutical industry for its potential as an anti-inflammatory agent. It has also shown promise in the development of new materials, particularly in the field of sensors and semiconductors.

What precautions should be taken when handling (4-Methoxy-7-(3-methyl-1H-1,2,4-triazol-1-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl)(oxo)acetic acid (CAS: 676491-47-7)?

Proper personal protective equipment (PPE) should be worn, including gloves and safety glasses. This compound should be handled in a well-ventilated area or under a fume hood. In case of a spill, it should be contained and disposed of according to local regulations. Always consult the Safety Data Sheet (SDS) for detailed handling instructions.

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Compound Q&A

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Compound Q&A

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Compound Q&A

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Compound Q&A

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[4-Methoxy-7-(3-methyl-1H-1,2,4-triazol-1-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl](oxo)acetic acid | CAS No. 676491-47-7

Basic Information

CAS Number

Molecular Formula

Molecular Weight

Chemical Classification

Basic Physical Properties

Chemical Properties

SMILES

InChI

InChIKey

LogP

Topological Polar Surface Area

Hydrogen Bond Donor/Acceptor

Complexity

Synonyms & References

English

MDL Number

FAQ

What are the physical and chemical properties of (4-Methoxy-7-(3-methyl-1H-1,2,4-triazol-1-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl)(oxo)acetic acid (CAS: 676491-47-7)?

How is (4-Methoxy-7-(3-methyl-1H-1,2,4-triazol-1-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl)(oxo)acetic acid (CAS: 676491-47-7) typically synthesized?

What industries use (4-Methoxy-7-(3-methyl-1H-1,2,4-triazol-1-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl)(oxo)acetic acid (CAS: 676491-47-7)?

What precautions should be taken when handling (4-Methoxy-7-(3-methyl-1H-1,2,4-triazol-1-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl)(oxo)acetic acid (CAS: 676491-47-7)?

Related Compounds

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What is Vinyl(chloromethyl)dimethoxysilane (CAS: 1314981-48-0)?

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