6-Benzyltetrahydro-1H-pyrrolo[3,4-b]pyridine-5,7(2H,6H)-dione | CAS No. 128740-13-6

6-Benzyltetrahydro-1H-pyrrolo[3,4-b]pyridine-5,7(2H,6H)-dione

Basic Information

CAS Number

128740-13-6

Molecular Formula

C14H16N2O2

Molecular Weight

244.29 g/mol

AD

Basic Physical Properties

Boiling Point

468.538 ℃ at 760 mmHg

C1CC2C(C(=O)N(C2=O)CC3=CC=CC=C3)NC1

InChI

InChI=1S/C14H16N2O2/c17-13-11-7-4-8-15-12(11)14(18)16(13)9-10-5-2-1-3-6-10/h1-3,5-6,11-12,15H,4,7-9H2

InChIKey

RRBLNPCNHNHAFW-UHFFFAOYSA-N

LogP

0.9236000000000002

Topological Polar Surface Area

49.410000000000004 Ų

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

350

Synonyms & References

English

  • CS-0146926
  • CHEMBL5027883
  • 6-benzyl-5,7-dioxo-octahydropyrrolo[3,4-b] pyridine, AldrichCPR
  • 6-benzyltetrahydro-1H-pyrrolo[3,4-b]pyridine-5,7(2H,6H)-dione
  • 6-benzyl -5,7-dioxo-octahydropyrrolo[3.4-b]pyridine
  • 128740-13-6
  • 6-Benzylhexahydro-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
  • RRBLNPCNHNHAFW-UHFFFAOYSA-N
  • AS-72903
  • Tetrahydro-6-(phenylmethyl)-1H-pyrrolo[3,4-b]pyridine-5,7(2H,6H)-dione
  • AKOS015911582
  • 1H-Pyrrolo[3,4-b]pyridine-5,7(2H,6H)-dione, tetrahydro-6-(phenylmethyl)-
  • SCHEMBL1721914
  • 6-Benzyl-5,7-dioxooctahydropyrrolo[3,4-b]pyridine
  • F16235
  • 6-BENZYL-5,7-DIOXO-OCTAHYDROPYRROLO[3,4-B]PYRIDINE
  • DTXSID70432551
  • EN300-27800
  • 6-benzyl-5,7-dioxo-octahydropyrrolo[3,4-b ]pyridine
  • A888977
  • 6-BENZYL-5,7-DIOXO-OCTAHYDROPYRROLO[3,4-B] PYRIDINE
  • 6-benzyl-1,2,3,4,4a,7a-hexahydropyrrolo[3,4-b]pyridine-5,7-dione
  • 6-benzyl-octahydro-1H-pyrrolo[3,4-b]pyridine-5,7-dione
  • FT-0660304
  • 6-Benzyl-5,7-dioxo-octahydropyrrolo[3.4-b]pyridine
  • 6-Benzyltetrahydro-1H-pyrrolo[3,4-b]pyridine-5,7(6H,7aH)-dione
  • AMY1696
  • 6-benzyl-tetrahydro-1H-pyrrolo[3,4-b]pyridine-5,7(6H,7aH)-dione
  • Tetrahydro-​6-​(phenylmethyl)​-1H-​pyrrolo[3,​4-​b]​pyridine-​5,​7(2H,​6H)​-​dione
  • 6-BENZYL-5,7-DIOXO-OCLAHYDROPYRROLO[3,4-B] PYRIDINE
  • 1H-pyrrolo[3,4-b]-5,7(2H,6H)-dione, tetrahydro-6-(phenylmethyl)

MDL Number

MFCD06795495

Customs Code

2933990090

FAQ

What regulatory guidelines apply to 6-Benzyltetrahydro-1H-pyrrolo[3,4-b]pyridine-5,7(2H,6H)-dione (CAS: 128740-13-6)?

The compound 6-Benzyltetrahydro-1H-pyrrolo[3,4-b]pyridine-5,7(2H,6H)-dione (CAS: 128740-13-6) falls under various regulatory guidelines. It should comply with GHS (Globally Harmonized System of Classification and Labeling of Chemicals) for classification and labeling. For production and import, it may be subject to REACH regulations in the EU. In the US, it is under the jurisdiction of the FDA for pharmaceuticals and the EPA for environmental concerns. Detailed safety data sheets (SDS) should be prepared and maintained for proper handling and storage.

Are there alternatives to 6-Benzyltetrahydro-1H-pyrrolo[3,4-b]pyridine-5,7(2H,6H)-dione in synthesis?

In the synthesis of 6-Benzyltetrahydro-1H-pyrrolo[3,4-b]pyridine-5,7(2H,6H)-dione (CAS: 128740-13-6), various alternatives can be considered. For instance, analogues such as 6-benzylpyridine or other substituted pyridines can be used as starting materials. Isomers like 5,7-dioxo-1-(2-methylpropyl)-1H-pyrrolo[3,4-b]pyridine can also be explored. Common alternative reagents include nitriles, amides, or sulfoxides, which can serve as precursors or intermediates in the synthetic route.

What is the market or research trend for 6-Benzyltetrahydro-1H-pyrrolo[3,4-b]pyridine-5,7(2H,6H)-dione (CAS: 128740-13-6)?

The market for 6-Benzyltetrahydro-1H-pyrrolo[3,4-b]pyridine-5,7(2H,6H)-dione (CAS: 128740-13-6) is growing steadily, driven by its applications in pharmaceuticals and agrochemicals. Research trends indicate increasing interest in its use as a potential drug candidate, particularly in treating neurological disorders. Additionally, there is a rising focus on developing new synthetic methods to improve the efficiency and yield of the compound. Price trends suggest that as demand increases, the cost may also rise, making it important to monitor market dynamics and supply chain.

How should waste containing 6-Benzyltetrahydro-1H-pyrrolo[3,4-b]pyridine-5,7(2H,6H)-dione (CAS: 128740-13-6) be handled?

Waste containing 6-Benzyltetrahydro-1H-pyrrolo[3,4-b]pyridine-5,7(2H,6H)-dione (CAS: 128740-13-6) should be managed in accordance with local and international regulations. It is advisable to collect waste liquids in appropriate containers, ensuring they are labeled with the correct hazard information. For solid waste, it should be stored in a secure, labeled container. Waste should be treated through incineration or professional waste disposal services. Environmental protection measures include ensuring that all waste is disposed of in a manner that minimizes environmental impact, adhering to best practices in chemical waste management.

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