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{5-[(3-Methyl-2-buten-1-yl)oxy]-2-[(2E)-3-{4-[(3-methyl-2-buten-1-yl)oxy]phenyl}-2-propenoyl]phenoxy}acetic acid(CAS: 64506-49-6)

{5-[(3-Methyl-2-buten-1-yl)oxy]-2-[(2E)-3-{4-[(3-methyl-2-buten-1-yl)oxy]phenyl}-2-propenoyl]phenoxy}acetic acid
CAS Number

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Basic Information

Molecular Formula
C27H30O6
Molecular Weight
450.53 g/mol

Physical Properties

Melting Point
143-148°C
Boiling Point
650°C at 760 mmHg
Density
1.1362 (rough estimate)

Chemical Identifiers

SMILES
CC(=CCOC1=CC=C(C=C1)C=CC(=O)C2=C(C=C(C=C2)OCC=C(C)C)OCC(=O)O)C
InChIKey
GFWRVVCDTLRWPK-KPKJPENVSA-N

Database References

MDL Number
MFCD00868207
Beilstein Registry Number
2191482

FAQ

The compound is a crystalline solid with a molecular weight of approximately 650 g/mol. It has a low solubility in water but is more soluble in organic solvents like methanol and acetonitrile. The compound is reactive, particularly towards nucleophiles and bases, and may undergo ester hydrolysis under basic conditions. It shows characteristics of a complex aromatic compound with potential for coordination chemistry.
The compound is synthesized via a multi-step process involving the synthesis of key intermediates such as 3-methyl-2-buten-1-ol and 4-(3-hydroxy-2-buten-1-yl)phenol. These intermediates are then used to construct the final compound through a series of coupling reactions and acylation steps, often using Lewis acids as catalysts to enhance selectivity and yield.
The compound is primarily used in pharmaceuticals and chemical research due to its complex structure and potential for drug development. It may also have applications in polymer chemistry for functionalized materials and in sensors for detecting specific chemical species.
Handling this compound requires appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. It should be stored in a cool, dark place away from heat and ignition sources. In case of spills, the area should be ventilated and the spill cleaned up using appropriate absorbents. 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

Contact Information

Email

bhchem1@gmail.com