4-(Heptyloxy)phenyl 4-(trans-4-pentylcyclohexyl)benzoate | CAS No. 84601-02-5

4-(Heptyloxy)phenyl 4-(trans-4-pentylcyclohexyl)benzoate

Basic Information

CAS Number

84601-02-5

Molecular Formula

C31H44O3

Molecular Weight

464.69 g/mol

AD

Basic Physical Properties

CCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3CCC(CC3)CCCCC

InChI

InChI=1S/C31H44O3/c1-3-5-7-8-10-24-33-29-20-22-30(23-21-29)34-31(32)28-18-16-27(17-19-28)26-14-12-25(13-15-26)11-9-6-4-2/h16-23,25-26H,3-15,24H2,1-2H3/t25-,26-

InChIKey

VEVLKNQODQPWJT-DIVCQZSQSA-N

LogP

9.1091

Topological Polar Surface Area

35.53 Ų

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

523

Synonyms & References

English

  • C31H44O3
  • 4-(Heptyloxy)phenyl 4-(trans-4-pentylcyclohexyl)benzoate
  • 4-(HEPTYLOXY)PHENYL 4-(4-PENTYLCYCLOHEXYL)BENZOATE
  • 4-(Heptyloxy)phenyl4-(trans-4-pentylcyclohexyl)benzoate
  • FT-0767232
  • DTXSID90856235
  • 4-Heptyloxyphenyl 4-trans-(4-pentylcyclohexyl)benzoate
  • 84601-02-5
  • (4-heptoxyphenyl) 4-(4-pentylcyclohexyl)benzoate

FAQ

What are the physical and chemical properties of 4-(Heptyloxy)phenyl 4-(trans-4-pentylcyclohexyl)benzoate (CAS: 84601-02-5)?

The compound has a crystalline form with a molecular weight of approximately 407.6 g/mol. It has a high solubility in organic solvents such as dichloromethane and a low solubility in water. Chemically, it is relatively stable but can react with strong acids and bases. It is non-toxic and does not exhibit strong reactivity under normal conditions.

How is 4-(Heptyloxy)phenyl 4-(trans-4-pentylcyclohexyl)benzoate (CAS: 84601-02-5) typically synthesized?

The compound is typically synthesized through a multistep reaction involving the formation of a phenol-derived intermediate, followed by esterification with a cyclohexyl derivative. Commonly used catalysts include sodium hydride and potassium carbonate. The reaction yields a product with high selectivity and good yield, ensuring purity and reliability for industrial applications.

What industries use 4-(Heptyloxy)phenyl 4-(trans-4-pentylcyclohexyl)benzoate (CAS: 84601-02-5)?

This compound is utilized in the pharmaceutical industry for its potential as a drug precursor, in polymers for its improved mechanical properties, and in sensors for its chemical sensitivity. It is also explored in the semiconductor industry for its application in photolithography and as a protective coating.

What precautions should be taken when handling 4-(Heptyloxy)phenyl 4-(trans-4-pentylcyclohexyl)benzoate (CAS: 84601-02-5)?

When handling the compound, it is essential to wear appropriate personal protective equipment (PPE), including gloves, goggles, and protective clothing. The compound should be stored in a fume hood or a well-ventilated area to minimize inhalation risks. In case of spillage, immediately clean up using appropriate absorbents and dispose of the waste according to safety data sheet (SDS) guidelines. Always refer to the SDS for specific safety instructions.

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