Methyl 1H-pyrrolo[2,3-b]pyridine-3-carboxylate

Basic Information

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CAS Number

808137-94-2

Molecular Formula

C9H8N2O2

Molecular Weight

176.18 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 Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

207-212°C

Density

1.324

SMILES

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COC(=O)c1c[nH]c2ncccc12

InChI

InChI=1S/C9H8N2O2/c1-13-9(12)7-5-11-8-6(7)3-2-4-10-8/h2-5H,1H3,(H,10,11)

InChIKey

XYRUNIAHPKBUJT-UHFFFAOYSA-N

LogP

1.3494999999999997

Topological Polar Surface Area

54.980000000000004 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

Methyl 1H-pyrrolo[2,3-b]pyridine-3-carboxylate
1H-PYRROLO[2,3-B]PYRIDINE-3-CARBOXYLIC ACID, METHYL ESTER
methyl 1H-pyrrolo[2,3-b]pyridine-3-carboxylate

MDL Number

MFCD09864656

Customs Code

2933990090

FAQ

What regulatory guidelines apply to Methyl 1H-pyrrolo[2,3-b]pyridine-3-carboxylate (CAS: 808137-94-2)?

Methyl 1H-pyrrolo[2,3-b]pyridine-3-carboxylate (CAS: 808137-94-2) is regulated under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations in the EU, and FDA/EPA guidelines for chemical handling and disposal. It is important to adhere to proper storage and handling procedures to ensure safety and environmental protection.

Are there alternatives to Methyl 1H-pyrrolo[2,3-b]pyridine-3-carboxylate (CAS: 808137-94-2) in synthesis?

There are several alternatives to Methyl 1H-pyrrolo[2,3-b]pyridine-3-carboxylate (CAS: 808137-94-2) in synthesis, including other pyridine derivatives such as 3-pyridinecarboxylic acid and 3-hydroxypyridine. These alternatives can serve similar functions in various chemical reactions, offering flexibility in synthesis approaches.

What is the market or research trend for Methyl 1H-pyrrolo[2,3-b]pyridine-3-carboxylate (CAS: 808137-94-2)?

Methyl 1H-pyrrolo[2,3-b]pyridine-3-carboxylate (CAS: 808137-94-2) shows increasing interest in pharmaceutical and material science research due to its unique chemical properties. Recent trends include its application in drug discovery and development, as well as its use in advanced materials. The market is expected to grow with ongoing research into its potential uses.

How should waste containing Methyl 1H-pyrrolo[2,3-b]pyridine-3-carboxylate (CAS: 808137-94-2) be handled?

Waste containing Methyl 1H-pyrrolo[2,3-b]pyridine-3-carboxylate (CAS: 808137-94-2) should be collected in appropriate containers and disposed of through professional waste disposal services. Incineration is a common method for disposal, ensuring complete destruction of the compound. Environmental protection measures should be followed to prevent contamination of soil and water sources.