2-(1-Piperidinyl)ethyl 3-methyl-4-oxo-2-phenyl-4H-chromene-8-carboxylate | CAS No. 15301-69-6

2-(1-Piperidinyl)ethyl 3-methyl-4-oxo-2-phenyl-4H-chromene-8-carboxylate

Basic Information

CAS Number

15301-69-6

Molecular Formula

C24H25NO4

Molecular Weight

391.47 g/mol

AD

Basic Physical Properties

Boiling Point

564.1°Cat760mmHg

Density

1.203

Flash Point

294.9°C

Refractive Index

1.591

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)OCCN3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C24H25NO4/c1-17-21(26)19-11-8-12-20(23(19)29-22(17)18-9-4-2-5-10-18)24(27)28-16-15-25-13-6-3-7-14-25/h2,4-5,8-12H,3,6-7,13-16H2,1H3

InChIKey

SPIUTQOUKAMGCX-UHFFFAOYSA-N

LogP

4.411120000000004

Topological Polar Surface Area

59.75000000000001 Ų

Hydrogen Bond Donor/Acceptor

0 / 5

Complexity

631

Synonyms & References

English

  • SPBio_002243
  • NCGC00016636-01
  • FT-0705368
  • W-61
  • InChI=1/C24H25NO4/c1-17-21(26)19-11-8-12-20(23(19)29-22(17)18-9-4-2-5-10-18)24(27)28-16-15-25-13-6-3-7-14-25/h2,4-5,8-12H,3,6-7,13-16H2,1H3
  • 2-(1-piperidyl)ethyl 3-methyl-4-oxo-2-phenyl-chromene-8-carboxylate
  • beta-piperidinoethyl 3-methylflavone-8-carboxylate
  • FLAVOXATE [VANDF]
  • 15301-69-6
  • Prestwick3_000242
  • 2-Piperidinoethyl 3-methyl-4-oxo-2-phenyl-4H-1-benzopyran-8-carboxylate
  • flavoxate
  • Flavoxatum
  • L001104
  • GTPL7187
  • 2-piperidin-1-ylethyl 3-methyl-4-oxo-2-phenylchromene-8-carboxylate
  • 3E74Y80MEY
  • SPIUTQOUKAMGCX-UHFFFAOYSA-
  • UNII-3E74Y80MEY
  • NCGC00016636-02
  • SPIUTQOUKAMGCX-UHFFFAOYSA-N
  • HWL
  • DTXSID3023053
  • Oprea1_293788
  • Prestwick1_000242
  • Prestwick2_000242
  • Flavossato
  • Flavoxate (INN)
  • CAS-3717-88-2
  • 4H-1-Benzopyran-8-carboxylic acid, 3-methyl-4-oxo-2-phenyl-, 2-(1-piperidinyl)ethyl ester
  • 2-Piperidinoethyl-3-methyl-4-oxo-2-phenyl-4H-1-benzopyran-8-carboxylate

MDL Number

MFCD00210291

FAQ

What are the physical and chemical properties of 2-(1-Piperidinyl)ethyl 3-methyl-4-oxo-2-phenyl-4H-chromene-8-carboxylate (CAS: 15301-69-6)?

2-(1-Piperidinyl)ethyl 3-methyl-4-oxo-2-phenyl-4H-chromene-8-carboxylate is a crystalline solid with a molecular weight of approximately 407.37 g/mol. It has low water solubility and moderate solubility in organic solvents like DMSO and DMF. The compound exhibits good stability under normal conditions but is sensitive to strong acids and bases. It is not reactive under standard laboratory conditions but may undergo hydrolysis under basic conditions.

How is 2-(1-Piperidinyl)ethyl 3-methyl-4-oxo-2-phenyl-4H-chromene-8-carboxylate (CAS: 15301-69-6) typically synthesized?

The compound is typically synthesized via a multistep procedure involving piperidine and chromone derivatives. Key steps include condensation reactions and esterification. Commonly, the piperidine ring is introduced first, followed by the chromone moiety. The final product is obtained with moderate to good yield, often around 70-80%, depending on the purity of starting materials and reaction conditions.

What industries use 2-(1-Piperidinyl)ethyl 3-methyl-4-oxo-2-phenyl-4H-chromene-8-carboxylate (CAS: 15301-69-6)?

2-(1-Piperidinyl)ethyl 3-methyl-4-oxo-2-phenyl-4H-chromene-8-carboxylate is primarily used in pharmaceuticals for developing new drug leads. It also finds applications in sensors for detecting specific analytes and in the production of certain polymers. Due to its chromene structure, it can be used in semiconductors for photovoltaic applications.

What precautions should be taken when handling 2-(1-Piperidinyl)ethyl 3-methyl-4-oxo-2-phenyl-4H-chromene-8-carboxylate (CAS: 15301-69-6)?

When handling 2-(1-Piperidinyl)ethyl 3-methyl-4-oxo-2-phenyl-4H-chromene-8-carboxylate, it is essential to wear appropriate personal protective equipment (PPE) including gloves, safety goggles, and a lab coat. Store the compound in a well-ventilated area, preferably in a fume hood. Immediately clean any spills with a suitable absorbent material and dispose of it according to local regulations. Always refer to the Safety Data Sheet (SDS) for detailed handling and disposal information.

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