5,6-Dimethoxy-2-(pyridin-4-ylmethylene)-2,3-dihydro-1H-inden-1-one | CAS No. 4803-74-1

5,6-Dimethoxy-2-(pyridin-4-ylmethylene)-2,3-dihydro-1H-inden-1-one

Basic Information

CAS Number

4803-74-1

Molecular Formula

C17H15NO3

Molecular Weight

281.31 g/mol

AD

Basic Physical Properties

Melting Point

210-211 ºC

Boiling Point

499.856°C at 760 mmHg

COC1=C(C=C2C(=C1)CC(=CC3=CC=NC=C3)C2=O)OC

InChI

InChI=1S/C17H15NO3/c1-20-15-9-12-8-13(7-11-3-5-18-6-4-11)17(19)14(12)10-16(15)21-2/h3-7,9-10H,8H2,1-2H3/b13-7+

InChIKey

SUVQWDLUAIFZKM-NTUHNPAUSA-N

LogP

2.9212000000000016

Topological Polar Surface Area

48.42 Ų

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

414

Safety Information

View Safety Information

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral
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

  • 1H-INDEN-1-ONE,2,3-DIHYDRO-5,6-DIMETHOXY-2-(4-PYRIDINYLMETHYLENE)-
  • (E)-5,6-Dimethoxy-2-(pyridin-4-ylmethylidene)- 2,3-dihydro-1H-inden-1-one
  • MFCD08458868
  • AS-12616
  • 5,6-Dimethoxy-2-(4-pyridylmethylene)-1-indanone (Donepezil Impurity)
  • 4803-74-1
  • 877606-65-0
  • 5,6-Dimethoxy-2-[(4-pyridyl)methylene]-1-indanone
  • 5,6-Dimethoxy-2-[(4-pyridyl)methylene]indan-1-one
  • (E)-5,6-dimethoxy-2-(pyridin-4-ylmethylene)-2,3-dihydroinden-1-one;5,6-Dimethoxy-2-(pyridin-4-ylmethylene)-2,3-dihydro-1H-inden-1-one
  • 5,6-dimethoxy-2-[(pyridin-4-yl)methylidene]-2,3-dihydro-1H-inden-1-one
  • DTXSID30468795
  • CS-0150560
  • (2E)-5,6-DIMETHOXY-2-(PYRIDIN-4-YLMETHYLIDENE)-3H-INDEN-1-ONE
  • P16891
  • (2E)-5,6-Dimethoxy-2-[(pyridin-4-yl)methylidene]-2,3-dihydro-1H-inden-1-one
  • AKOS015889314
  • AC-4723
  • 5,6-Dimethoxy-2-(pyridin-4-ylmethylene)-2,3-dihydro-1H-inden-1-one
  • A7321
  • 1H-Inden-1-one, 2,3-dihydro-5,6-dimethoxy-2-(4-pyridinylmethylene)-
  • (5,6-Dimethoxy-2-(pyridine-4-yl)methylene-indan-1-one)
  • Q-100520
  • (E)-5,6-dimethoxy-2-(pyridin-4-ylmethylene)-2,3-dihydro-1H-inden-1-one
  • 5,6-Dimethoxy-2-(pyridine-4-yl)methylene-indan-1-o ne
  • 5,6-Dimethoxy-2-(pyridine-4-yl)methylene-indan-1-one
  • 5,6-Dimethoxy-2-(pyridin-4-yl)methylene-indan-1-one
  • 2,3-Dihydro-5,6-dimethoxy-2-(4-pyridinylmethylene)-1H-inden-1-one
  • 5,6-dimethoxy-2-(4-pyridylmethylene)-1-Indanone
  • (2E)-5,6-dimethoxy-2-(pyridin-4-ylmethylidene)-3H-inden-1-one
  • RP29859

MDL Number

MFCD08458868

FAQ

What are the physical and chemical properties of 5,6-Dimethoxy-2-(pyridin-4-ylmethylene)-2,3-dihydro-1H-inden-1-one (CAS: 4803-74-1)?

5,6-Dimethoxy-2-(pyridin-4-ylmethylene)-2,3-dihydro-1H-inden-1-one is a crystalline compound with a molecular weight of approximately 272.17 g/mol. It has a solubility of 0.1 g/L in water and is less soluble in organic solvents. The compound exhibits moderate reactivity towards nucleophiles and electrophiles, making it suitable for various chemical transformations. It is stable under normal conditions but requires careful handling to avoid decomposition.

How is 5,6-Dimethoxy-2-(pyridin-4-ylmethylene)-2,3-dihydro-1H-inden-1-one (CAS: 4803-74-1) typically synthesized?

5,6-Dimethoxy-2-(pyridin-4-ylmethylene)-2,3-dihydro-1H-inden-1-one can be synthesized via a Claisen condensation reaction of 5,6-dimethoxy-2-indanone with 4-pyridylmethyl chloroformate in the presence of a base like triethylamine. The reaction is carried out under anhydrous conditions to ensure high yield and selectivity. The method is widely used in synthetic organic chemistry for the preparation of related compounds.

What industries use 5,6-Dimethoxy-2-(pyridin-4-ylmethylene)-2,3-dihydro-1H-inden-1-one (CAS: 4803-74-1)?

5,6-Dimethoxy-2-(pyridin-4-ylmethylene)-2,3-dihydro-1H-inden-1-one finds applications in the pharmaceutical industry for its potential as a precursor in the synthesis of bioactive compounds. It is also used in the semiconductor industry for its electronic properties and in the development of advanced polymers. Additionally, it can be used in the production of sensors and other specialized chemical products.

What precautions should be taken when handling 5,6-Dimethoxy-2-(pyridin-4-ylmethylene)-2,3-dihydro-1H-inden-1-one (CAS: 4803-74-1)?

When handling 5,6-Dimethoxy-2-(pyridin-4-ylmethylene)-2,3-dihydro-1H-inden-1-one, appropriate personal protective equipment (PPE) should be worn, including gloves, laboratory coat, and safety goggles. The compound should be stored in a cool, dry place, away from direct sunlight and heat sources. In case of spillage, it should be handled in a fume hood, and the spill should be cleaned up using appropriate absorbent materials. Always refer to the Safety Data Sheet (SDS) for detailed handling and storage instructions.

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