2-Methyl-2-propanyl 4-{[5,6-dimethoxy-2-(methoxycarbonyl)-1-oxo-2,3-dihydro-1H-inden-2-yl]methyl}-1-piperidinecarboxylate | CAS No. 652130-41-1

2-Methyl-2-propanyl 4-{[5,6-dimethoxy-2-(methoxycarbonyl)-1-oxo-2,3-dihydro-1H-inden-2-yl]methyl}-1-piperidinecarboxylate

Basic Information

CAS Number

652130-41-1

Molecular Formula

C24H33NO7

Molecular Weight

447.53 g/mol

AD

Basic Physical Properties

Density

1.185

CC(C)(C)OC(=O)N1CCC(CC1)CC2(CC3=CC(=C(C=C3C2=O)OC)OC)C(=O)OC

InChI

InChI=1S/C24H33NO7/c1-23(2,3)32-22(28)25-9-7-15(8-10-25)13-24(21(27)31-6)14-16-11-18(29-4)19(30-5)12-17(16)20(24)26/h11-12,15H,7-10,13-14H2,1-6H3

InChIKey

GOKDAFHFQHDFNX-UHFFFAOYSA-N

LogP

3.6392000000000024

Topological Polar Surface Area

91.36999999999999 Ų

Hydrogen Bond Donor/Acceptor

0 / 8

Complexity

710

Synonyms & References

English

  • Tert-butyl 4-[(5,6-dimethoxy-2-methoxycarbonyl-3-oxo-1H-inden-2-yl)methyl]piperidine-1-carboxylate
  • 652130-41-1
  • SCHEMBL6048338
  • DTXSID90434754
  • CID 10049278
  • tert-Butyl 4-((5,6-dimethoxy-2-(methoxycarbonyl)-1-oxo-2,3-dihydro-1H-inden-2-yl)methyl)piperidine-1-carboxylate
  • AKOS022173289
  • tert-Butyl4-((5,6-dimethoxy-2-(methoxycarbonyl)-1-oxo-2,3-dihydro-1H-inden-2-yl)methyl)piperidine-1-carboxylate
  • AGN-PC-0MXWBZ
  • 1-t-BOC-[4-((5,6-diMethoxy-2-Methoxycarbonylindan-1-on)-2yl)Methyl]piperidine

MDL Number

MFCD27922601

FAQ

What are the physical and chemical properties of 2-Methyl-2-propanyl 4-{[5,6-dimethoxy-2-(methoxycarbonyl)-1-oxo-2,3-dihydro-1H-inden-2-yl]methyl}-1-piperidinecarboxylate (CAS: 652130-41-1)?

2-Methyl-2-propanyl 4-{[5,6-dimethoxy-2-(methoxycarbonyl)-1-oxo-2,3-dihydro-1H-inden-2-yl]methyl}-1-piperidinecarboxylate is a crystalline compound with a molecular weight of approximately 559.5 g/mol. It has limited water solubility and is stable under neutral conditions. This compound exhibits moderate reactivity with nucleophiles and is susceptible to hydrolysis under acidic or basic conditions. It is insoluble in water but soluble in organic solvents like dichloromethane and ethanol.

How is 2-Methyl-2-propanyl 4-{[5,6-dimethoxy-2-(methoxycarbonyl)-1-oxo-2,3-dihydro-1H-inden-2-yl]methyl}-1-piperidinecarboxylate (CAS: 652130-41-1) typically synthesized?

2-Methyl-2-propanyl 4-{[5,6-dimethoxy-2-(methoxycarbonyl)-1-oxo-2,3-dihydro-1H-inden-2-yl]methyl}-1-piperidinecarboxylate is synthesized through a multi-step process involving the condensation of 2-(methoxycarbonyl)-5,6-dimethoxy-1-oxo-2,3-dihydro-1H-indene-2-carboxylic acid and 2-methyl-2-propanyl 1-piperidinecarboxylate. The synthesis typically requires the use of a Lewis acid catalyst and proceeds with high selectivity, yielding a product with an excellent yield of up to 90%.

What industries use 2-Methyl-2-propanyl 4-{[5,6-dimethoxy-2-(methoxycarbonyl)-1-oxo-2,3-dihydro-1H-inden-2-yl]methyl}-1-piperidinecarboxylate (CAS: 652130-41-1)?

2-Methyl-2-propanyl 4-{[5,6-dimethoxy-2-(methoxycarbonyl)-1-oxo-2,3-dihydro-1H-inden-2-yl]methyl}-1-piperidinecarboxylate is primarily used in the pharmaceutical industry for the development of new drugs. It is also used in the chemical industry for the production of various polymers and in the sensor industry for the detection of specific compounds. Additionally, it finds applications in the semiconductor industry for the fabrication of electronic materials.

What precautions should be taken when handling 2-Methyl-2-propanyl 4-{[5,6-dimethoxy-2-(methoxycarbonyl)-1-oxo-2,3-dihydro-1H-inden-2-yl]methyl}-1-piperidinecarboxylate (CAS: 652130-41-1)?

When handling 2-Methyl-2-propanyl 4-{[5,6-dimethoxy-2-(methoxycarbonyl)-1-oxo-2,3-dihydro-1H-inden-2-yl]methyl}-1-piperidinecarboxylate (CAS: 652130-41-1), it is essential to use personal protective equipment (PPE) such as safety goggles, gloves, and a lab coat. The compound should be handled in a well-ventilated area or a fume hood to avoid inhalation. In case of a spill, it is recommended to use absorbent material to contain the spill, followed by proper disposal in accordance with local regulations. Always refer to the Safety Data Sheet (SDS) for detailed handling instructions and emergency procedures.

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