4-Benzylidene-2,6-bis(2-methyl-2-propanyl)-2,5-cyclohexadien-1-one | CAS No. 7078-98-0

4-Benzylidene-2,6-bis(2-methyl-2-propanyl)-2,5-cyclohexadien-1-one

Basic Information

CAS Number

7078-98-0

Molecular Formula

C21H26O

Molecular Weight

294.44 g/mol

AD

Basic Physical Properties

CC(C)(C)C1=CC(=CC2=CC=CC=C2)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C21H26O/c1-20(2,3)17-13-16(12-15-10-8-7-9-11-15)14-18(19(17)22)21(4,5)6/h7-14H,1-6H3

InChIKey

HCUWXYBKPSKTAB-UHFFFAOYSA-N

LogP

5.597700000000005

Topological Polar Surface Area

17.07 Ų

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

487

Synonyms & References

English

  • 4-benzylidene-2,6-di-tert-butylcyclohexa-2,5-dienone
  • 4-benzylidene-2,6-di-t-butylcyclohexa-2,5-dienone
  • CS-16265
  • 4-benzylidene-2,6-di-tert-butylcyclohexa-2,5-dien-1-one
  • 4-Benzylidene-2,6-ditert-butyl-2,5-cyclohexadien-1-one #
  • EN300-22936825
  • 7078-98-0
  • 2,6-bis(1,1-dimethylethyl)-4-(phenylenemethylene)cyclohexa-2,5-dien-1-one
  • D75555
  • AMY322
  • 2,6-DI-TERT-BUTYL-4-(PHENYLMETHYLIDENE)CYCLOHEXA-2,5-DIEN-1-ONE
  • 2,6-Bis(1,1-dimethylethyl)-4-phenylmethylenecyclohexa-2,5-dien-1-one
  • NS00009502
  • A1-24399
  • 2,5-Cyclohexadien-1-one, 2,6-bis(1,1-dimethylethyl)-4-(phenylmethylene)-
  • SCHEMBL86407
  • 2,6-BIS(1,1-DIMETHYLETHYL)-4-(PHENYLMETHYLENE)-2,5-CYCLOHEXADIEN-1-ONE
  • EC 429-460-4
  • CS-0094455
  • DTXSID6052453
  • 2,6-di-tert.-butyl-4-benzylidene-2,5-cyclohexadien-one
  • AKOS001720844
  • 4-benzylidene-2,6-ditert-butylcyclohexa-2,5-dien-1-one
  • 2,5-Cyclohexadien-1-one,2,6-bis(1,1-dimethylethyl)-4-(phenylmethylene)-
  • 2,5-cyclohexadien-1-one,2,6-bis(1,1-dimethylethyl)-4-(phenylmethylene)
  • 1 DU1R&amp
  • 1&amp
  • 2,6-Bis(1,1-dimethylethyl)-4-(phenylmethylene)cyclohexa-2,5-dien-1-one
  • 429-460-4
  • FX1&amp
  • L6V DYJ BX1&amp

MDL Number

MFCD00514861

FAQ

What regulatory guidelines apply to 4-Benzylidene-2,6-bis(2-methyl-2-propanyl)-2,5-cyclohexadien-1-one (CAS: 7078-98-0)?

4-Benzylidene-2,6-bis(2-methyl-2-propanyl)-2,5-cyclohexadien-1-one (CAS: 7078-98-0) is subject to classification under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), including requirements for hazard communication and labeling. In the European Union, it is regulated under the Registration, Evaluation, Authorization and Restriction of Chemicals (REACH) regulation. Additionally, the U.S. FDA and EPA have specific guidelines regarding the safe handling and disposal of this compound.

Are there alternatives to 4-Benzylidene-2,6-bis(2-methyl-2-propanyl)-2,5-cyclohexadien-1-one (CAS: 7078-98-0) in synthesis?

Several alternatives can be used in the synthesis of 4-Benzylidene-2,6-bis(2-methyl-2-propanyl)-2,5-cyclohexadien-1-one (CAS: 7078-98-0). For example, 4-Phenyl-2,6-bis(2-methylpropyl)-2,5-cyclohexadien-1-one or similar compounds can be considered. Additionally, substituting the benzylidene group with other functional groups like acetyl or propionyl can provide viable alternatives.

What is the market or research trend for 4-Benzylidene-2,6-bis(2-methyl-2-propanyl)-2,5-cyclohexadien-1-one (CAS: 7078-98-0)?

The market for 4-Benzylidene-2,6-bis(2-methyl-2-propanyl)-2,5-cyclohexadien-1-one (CAS: 7078-98-0) is driven by its applications in flavor and fragrance industries. Research trends indicate increasing interest in its use as a precursor for synthetic fragrances. Moreover, ongoing studies focus on exploring its potential in pharmaceutical and chemical intermediates, driven by favorable market dynamics and evolving demand.

How should waste containing 4-Benzylidene-2,6-bis(2-methyl-2-propanyl)-2,5-cyclohexadien-1-one (CAS: 7078-98-0) be handled?

Waste containing 4-Benzylidene-2,6-bis(2-methyl-2-propanyl)-2,5-cyclohexadien-1-one (CAS: 7078-98-0) should be collected in appropriate containers, ensuring proper sealing to prevent spillage. For disposal, it must be handled by a licensed waste management facility that can provide safe incineration or professional chemical waste disposal. Environmental protection measures, such as neutralization or stabilization, should be implemented to minimize environmental impact.

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