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CS-W001157 4
Total: USD 88.00

1-(tert-Butyl)-3,5-dimethylbenzene

  • CAS No. 98-19-1

  • Cat. No. CS-0179763
  • Purity≥98%
  • MDL No.MFCD00008832

*For research and further manufacturing use only, not for direct human use.

1-(tert-Butyl)-3,5-dimethylbenzene|CS-0179763

Structure of 98-19-1

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General Information

  • CAS No. 98-19-1
  • Cat. No. CS-0179763
  • Purity ≥98%
  • MDL No. MFCD00008832
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₈
  • Molecular Weight 162.28
  • Synonym(s) 5-tert-Butyl-m-xylene
  • SMILES CC1=CC(C)=CC(C(C)(C)C)=C1

Description

1-tert-Butyl-3,5-dimethylbenzene participates in the cascade diarylation of N-phenylacetamides with non-prefunctionalized arenes.1-tert-Butyl-3,5-dimethylbenzene has been used in the synthesis of bulky, multi-alkylated diaryl disulfides such as bis(4-tert-butyl-2,6-dimethylphenyl) disulfide and bis(2,4,6-triisopropylphenyl) disulfide.

Synthesis

  • Route1
    • null|null
      108-38-3
    • null|null
      75-65-0
    • ~59%
    • In-stock
      1-(tert-Butyl)-3,5-dimethylbenzene|CS-0179763
      98-19-1

    References

    • Isakov; Minachev; Kalinin; Isakova Russian Chemical Bulletin, 1996 , vol. 45, # 12 p. 2763 - 2768
  • Route2
    • In-stock
      1-Bromo-3,5-dimethylbenzene|CS-W016968
      556-96-7
    • null|null
      677-22-5
    • ~85%
    • In-stock
      1-(tert-Butyl)-3,5-dimethylbenzene|CS-0179763
      98-19-1

    References

    • Joshi-Pangu, Amruta; Wang, Chao-Yuan; Biscoe, Mark R. Journal of the American Chemical Society, 2011 , vol. 133, # 22 p. 8478 - 8481
  • Route3
    • null|null
      108-38-3
    • null|null
      115-11-7
    • ~%
    • In-stock
      1-(tert-Butyl)-3,5-dimethylbenzene|CS-0179763
      98-19-1
    • null|null
      14411-55-3

    References

    • US2004/152934 A1, ; Page 4 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P260-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P337+P313-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   0
  • LogP   3.60094
  • H_Acceptors   0
  • H_Donors   0
  • Rotatable_Bonds   0

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