3-(2-Methoxy-5-methylphenyl)-3-phenylpropyl 4-methylbenzenesulfonate | CAS No. 124937-85-5

3-(2-Methoxy-5-methylphenyl)-3-phenylpropyl 4-methylbenzenesulfonate

Basic Information

CAS Number

124937-85-5

Molecular Formula

C24H26O4S

Molecular Weight

410.54 g/mol

AD

Basic Physical Properties

Solubility

Insuluble (2.1E-4 g/L) (25 ºC),

CC1=CC=C(C=C1)S(=O)(=O)OCCC(C2=CC=CC=C2)C3=C(C=CC(=C3)C)OC

InChI

InChI=1S/C24H26O4S/c1-18-9-12-21(13-10-18)29(25,26)28-16-15-22(20-7-5-4-6-8-20)23-17-19(2)11-14-24(23)27-3/h4-14,17,22H,15-16H2,1-3H3

InChIKey

XFMJXASCGLTHSN-UHFFFAOYSA-N

LogP

5.239540000000006

Topological Polar Surface Area

52.60000000000001 Ų

Hydrogen Bond Donor/Acceptor

0 / 4

Synonyms & References

English

  • 3-(2-Methoxy-5-methylphenyl)-3-phenylpropyl 4-methylbenzenesulfonate
  • 3-(2-methoxy-5-methylphenyl)-3-phenylpropyl p-toluenesulphonate
  • toluene-4-sulfonic acid-3-(2-methoxy-5-methyl-phenyl)-3-phenyl propyl ester
  • 3-(2-Methoxy-5-methylphenyl)-3-phenylpropyl p-toluenesulfonate
  • 2-Methoxy-5-Methyl-g-phenyl-Benzenepropanol 1-(4-Methylbenzenesulfote)
  • 2-methoxy-5-methyl-γ-phenyl-Benzenepropanol,1-(4-methylbenzenesulfonate)
  • 2-Methoxy-5-Methyl-g-phenyl-Benzenepropanol 1-(4-Methylbenzenesulfonate)

MDL Number

MFCD23135562

FAQ

What is 3-(2-Methoxy-5-methylphenyl)-3-phenylpropyl 4-methylbenzenesulfonate (CAS: 124937-85-5)?

3-(2-Methoxy-5-methylphenyl)-3-phenylpropyl 4-methylbenzenesulfonate is a complex organic compound with the CAS number 124937-85-5. It is a derivative of benzenesulfonate and features a phenyl group, a methoxy group, a methyl group, and a 3-phenylpropyl group. This compound is typically used in pharmaceuticals and research due to its specific chemical structure and properties.

What are the main uses of 3-(2-Methoxy-5-methylphenyl)-3-phenylpropyl 4-methylbenzenesulfonate (CAS: 124937-85-5)?

3-(2-Methoxy-5-methylphenyl)-3-phenylpropyl 4-methylbenzenesulfonate is primarily used in pharmaceutical applications, particularly as an intermediate for the synthesis of other medicinal compounds. It is also utilized in research settings for its specific chemical properties and potential biological activity.

Is 3-(2-Methoxy-5-methylphenyl)-3-phenylpropyl 4-methylbenzenesulfonate (CAS: 124937-85-5) safe?

3-(2-Methoxy-5-methylphenyl)-3-phenylpropyl 4-methylbenzenesulfonate is generally safe when handled with proper precautions. It is important to follow standard safety guidelines, including wearing appropriate personal protective equipment (PPE) such as gloves and goggles. Handling this compound should be done in a well-ventilated area or a fume hood to minimize inhalation risks.

How should 3-(2-Methoxy-5-methylphenyl)-3-phenylpropyl 4-methylbenzenesulfonate (CAS: 124937-85-5) be stored?

3-(2-Methoxy-5-methylphenyl)-3-phenylpropyl 4-methylbenzenesulfonate should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed, airtight container to prevent moisture absorption. The storage temperature should be below 25°C (77°F) to maintain its stability and prevent degradation. Ensure good ventilation in the storage area to avoid the risk of flammable vapors accumulating.

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