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CS-W001157 4
Total: USD 88.00

5-(Tert-butyl)-2-methylbenzo[d]oxazole

  • CAS No. 40874-54-2

  • Cat. No. CS-0452350
  • Purity≥98%
  • MDL No.None

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

5-(Tert-butyl)-2-methylbenzo[d]oxazole|CS-0452350

Structure of 40874-54-2

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General Information

  • CAS No. 40874-54-2
  • Cat. No. CS-0452350
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₅NO
  • Molecular Weight 189.25
  • Synonym(s) 5-(tert-Butyl)-2-methylbenzoxazole
  • SMILES CC1=NC2=C(C=CC(=C2)C(C)(C)C)O1

Synthesis

  • Route1

    References

    • PHANOS TECHNOLOGIES, INC. Patent: WO2007/61768 A2, 2007 ; Location in patent: Page/Page column 20-21 ;
  • Route2

    References

    • Dulong, Florian; Thuery, Pierre; Ephritikhine, Michel; Cantat, Thibault Organometallics, 2013 , vol. 32, # 5 p. 1328 - 1340
  • Route3

    References

    • Anish Patent: US2429178 , 1944 ; Full Text Show Details Gen. Aniline and Film Corp. Patent: US2441342 , 1944 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.03
  • LogP   3.43372
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   0

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