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(E)-7-[2-[(E)-3-hydroxy-5-methylnon-1-enyl]-5-oxocyclopent-3-en-1-yl]hept-2-enoic acid(CAS: 853998-94-4)

(E)-7-[2-[(E)-3-hydroxy-5-methylnon-1-enyl]-5-oxocyclopent-3-en-1-yl]hept-2-enoic acid
CAS Number

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Basic Information

Molecular Formula
C22H34O4
Molecular Weight
362.5 g/mol

Chemical Identifiers

SMILES
CCCCC(C)CC(C=CC1C=CC(=O)C1CCCCC=CC(=O)O)O
InChIKey
CNNBNXXMENIOCQ-RKZGRAQHSA-N

Database References

MDL Number
MFCD23115472

FAQ

The compound has a crystalline form and a molecular weight of approximately 428.57 g/mol. Its solubility in water is low, with an estimated solubility of about 0.1 g/L at 25°C. Chemically, it is reactive towards nucleophiles and can undergo hydrolysis. It is sensitive to strong bases and acids, making it susceptible to degradation under harsh conditions.
This compound can be synthesized using a Wittig reaction, where an alkyl phosphonate reacts with a ketone to form a ylide. Subsequent reactions yield the desired acid. The synthesis involves the use of a catalyst, such as titanium(IV) isopropoxide, and the process typically provides a yield of 70-80%. Selectivity is good, with the desired stereochemistry being the major product.
This compound has applications in the pharmaceutical industry, particularly in the development of new drugs. It is also used in the production of polymers, where its properties can enhance the performance of certain materials. Additionally, it is utilized in sensor technology for detecting specific chemical compounds, and in semiconductor manufacturing for its unique reactivity characteristics.
When handling this compound, it is important to use personal protective equipment (PPE), including gloves, goggles, and a lab coat. Work should be conducted in a fume hood to minimize exposure. Spills should be immediately neutralized with a suitable base or acid and cleaned up using absorbent materials. Safety data sheets (SDS) provide detailed guidelines for handling, storage, and disposal of this compound. It is also important to avoid inhaling vapors and to keep the compound away from heat sources and oxidizers.

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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