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2-(3,4-Dimethoxyphenyl)-5,7-dimethoxy-4H-chromen-4-one(CAS: 855-97-0)

2-(3,4-Dimethoxyphenyl)-5,7-dimethoxy-4H-chromen-4-one
CAS Number

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Basic Information

Molecular Formula
C19H18O6
Molecular Weight
342.35 g/mol

Physical Properties

Melting Point
195-197°C
Boiling Point
528.8°C at 760 mmHg
Density
1.243
Flash Point
233.9°C

Chemical Identifiers

SMILES
COc1cc(OC)c2c(c1)oc(cc2=O)c1ccc(c(c1)OC)OC
InChIKey
CLXVBVLQKLQNRQ-UHFFFAOYSA-N

Database References

MDL Number
MFCD00017558
Beilstein Registry Number
336320

FAQ

2-(3,4-Dimethoxyphenyl)-5,7-dimethoxy-4H-chromen-4-one (CAS: 855-97-0) is a crystalline compound with a molecular weight of approximately 348.24 g/mol. It is slightly soluble in water but more soluble in polar organic solvents like ethanol and acetone. The compound exhibits moderate reactivity, particularly in aromatic substitution reactions. It has a pKa around 4.5, indicating its basicity.
2-(3,4-Dimethoxyphenyl)-5,7-dimethoxy-4H-chromen-4-one (CAS: 855-97-0) can be synthesized via a multistep process involving the protection of phenol groups, followed by a Diels-Alder reaction. Commonly, this involves treating 2,3,4-trimethoxybenzaldehyde with a chromenone derivative under anhydrous conditions, using a catalytic amount of a Lewis acid like aluminum chloride. The reaction is typically carried out in a chlorinated solvent such as dichloromethane, yielding the target compound with good to excellent selectivity and up to 90% yield.
2-(3,4-Dimethoxyphenyl)-5,7-dimethoxy-4H-chromen-4-one (CAS: 855-97-0) finds applications in the pharmaceutical industry as a precursor for drug development, particularly in the synthesis of active pharmaceutical ingredients. It is also used in the polymer industry as a chromophore for colorants and dyes. Additionally, it has potential uses in sensor technology and semiconductor manufacturing, where its chromophoric properties are utilized.
When handling 2-(3,4-Dimethoxyphenyl)-5,7-dimethoxy-4H-chromen-4-one (CAS: 855-97-0), it is important to use appropriate personal protective equipment (PPE) including gloves, laboratory coat, and safety goggles. The compound should be handled in a well-ventilated fume hood to minimize inhalation risks. Spills should be cleaned up using absorbent materials and disposed of according to local regulations. Always refer to the Safety Data Sheet (SDS) for detailed handling and disposal instructions.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

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