Benzoic acid--2,6-di(propan-2-yl)phenol (1/1) | CAS No. 2005-09-6

Benzoic acid--2,6-di(propan-2-yl)phenol (1/1)

Basic Information

CAS Number

2005-09-6

Molecular Formula

C19H22O2

Molecular Weight

282.38 g/mol

AD

Basic Physical Properties

CC(C)C1=C(C(=CC=C1)C(C)C)O.C1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C19H22O2/c1-13(2)16-11-8-12-17(14(3)4)18(16)21-19(20)15-9-6-5-7-10-15/h5-14H,1-4H3

InChIKey

FWWZVJVOMUKVKV-UHFFFAOYSA-N

LogP

5.152600000000005

Topological Polar Surface Area

26.3 Ų

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

239

Synonyms & References

English

  • Phenol, 2,6-bis(1-methylethyl)-, benzoate
  • 2005-09-6
  • DTXSID10782567
  • benzoic acid;2,6-di(propan-2-yl)phenol
  • Benzoic acid--2,6-di(propan-2-yl)phenol (1/1)
  • Propofol Benzoate

FAQ

What are the physical and chemical properties of Benzoic acid--2,6-di(propan-2-yl)phenol (CAS: 2005-09-6)?

Benzoic acid--2,6-di(propan-2-yl)phenol is a crystalline solid with a molecular weight of approximately 246.35 g/mol. It has a melting point of 47-49°C and is slightly soluble in water. Chemically, it exhibits mild acidity and can undergo esterification and condensation reactions. It is used as a flavoring agent and in the production of dyes and pharmaceuticals.

How is Benzoic acid--2,6-di(propan-2-yl)phenol (CAS: 2005-09-6) typically synthesized?

Benzoic acid--2,6-di(propan-2-yl)phenol is typically synthesized by the reaction of 2,6-di(propan-2-yl)phenol with benzoic anhydride in the presence of a catalyst such as pyridine. The process yields a high purity product with excellent selectivity and yield. This compound is often prepared through condensation reactions in organic synthesis.

What industries use Benzoic acid--2,6-di(propan-2-yl)phenol (CAS: 2005-09-6)?

Benzoic acid--2,6-di(propan-2-yl)phenol is used in the pharmaceutical industry as an intermediate for drug synthesis, in the polymer industry as a stabilizer, and in the food industry as a flavoring agent. It also finds applications in the sensor and semiconductor industries due to its chemical properties.

What precautions should be taken when handling Benzoic acid--2,6-di(propan-2-yl)phenol (CAS: 2005-09-6)?

Handling Benzoic acid--2,6-di(propan-2-yl)phenol requires appropriate personal protective equipment (PPE) including gloves, safety glasses, and laboratory coat. It should be stored in a dry, cool place and away from heat sources. In case of spill, use appropriate absorbent materials and consult the Material Safety Data Sheet (MSDS) for further instructions. Always use a fume hood when handling this compound to avoid inhalation exposure.

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