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CS-W001157 4
Total: USD 88.00

Tert-butyl 2-methylbenzoate

  • CAS No. 16537-18-1

  • Cat. No. CS-0336933
  • Purity95+%
  • MDL No.None

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

Tert-butyl 2-methylbenzoate|CS-0336933

Structure of 16537-18-1

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General Information

  • CAS No. 16537-18-1
  • Cat. No. CS-0336933
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₆O₂
  • Molecular Weight 192.25
  • Synonym(s) tert-butyl o-methylbenzoate
  • SMILES CC1=CC=CC=C1C(=O)OC(C)(C)C

Synthesis

  • Route1
    • null|null
      933-88-0
    • null|null
      75-65-0
    • ~86%
    • Tert-butyl 2-methylbenzoate|CS-0336933
      16537-18-1

    References

    • Torun, Lokman; Robison, Thomas W.; Krzykawski, Jan; Purkiss, David W.; Bartsch, Richard A. Tetrahedron, 2005 , vol. 61, # 35 p. 8345 - 8350
  • Route2

    References

    • Zhang, Hua; Shi, Renyi; Ding, Anxing; Lu, Lijun; Chen, Borui; Lei, Aiwen Angewandte Chemie - International Edition, 2012 , vol. 51, # 50 p. 12542 - 12545
  • Route3

    References

    • Wu, Yusheng; Li, Xinjian; Zou, Dapeng; Zhu, Helong; Wang, Yaping; Li, Jingya; Wu, Yangjie Organic Letters, 2014 , vol. 16, # 7 p. 1836 - 1839

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   2.95032
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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