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CS-W001157 4
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1-(2-Bromoethyl)-3-methylbenzene

  • CAS No. 16799-08-9

  • Cat. No. CS-0068036
  • Purity≥98%
  • MDL No.MFCD04117468

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

1-(2-Bromoethyl)-3-methylbenzene|CS-0068036

Structure of 16799-08-9

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General Information

  • CAS No. 16799-08-9
  • Cat. No. CS-0068036
  • Purity ≥98%
  • MDL No. MFCD04117468
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₁Br
  • Molecular Weight 199.09
  • Synonym(s) 3-Methylphenethyl Bromide
  • SMILES CC1=CC(CCBr)=CC=C1

Synthesis

  • Route1

    References

    • Mitra, Ashutosh; Ghoshe, Swati Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1996 , vol. 35, # 8 p. 785 - 789
  • Route2

    References

    • DuPont Pharmaceuticals Company Patent: US6060462 A1, 2000 ; US 6060462 A
  • Route3
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    • 1-(2-Bromoethyl)-3-methylbenzene|CS-0068036
      16799-08-9

    References

    • Bogert; Apfelbaum Journal of the American Chemical Society, 1938 , vol. 60, p. 930,932 Full Text Show Details Speer; Hill Journal of Organic Chemistry, 1937 , vol. 2, p. 139,143

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07,GHS09
Signal Word : Warning
UN#: 3082
Class : 9
Packing Group : Ⅲ
Hazard Statements : H302-H315-H319-H335-H401-H411
Precautionary Statements : P261-P264-P270-P271-P273-P280-P302+P352-P305+P351+P338-P362-P391-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   0
  • LogP   2.93242
  • H_Acceptors   0
  • H_Donors   0
  • Rotatable_Bonds   2

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