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CS-W001157 4
Total: USD 88.00

1-(3-Bromobenzyl)-4-methylpiperazine

  • CAS No. 331977-03-8

  • Cat. No. CS-0451158
  • Molecule weight269.18
  • Purity≥98%
  • MDL No.None

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

1-(3-Bromobenzyl)-4-methylpiperazine|CS-0451158

Structure of 331977-03-8

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General Information

  • CAS No. 331977-03-8
  • Cat. No. CS-0451158
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₇BrN₂
  • Molecular Weight 269.18
  • Synonym(s) 1-[(3-BROMOPHENYL)METHYL]-4-METHYLPIPERAZINE
  • SMILES CN1CCN(CC1)CC2=CC(=CC=C2)Br

Synthesis

  • Route1

    References

    • F. HOFFMANN-LA ROCHE AG Patent: WO2008/28617 A1, 2008 ; Location in patent: Page/Page column 44-45 ; WO 2008/028617 A1
  • Route2

    References

    • Duffey, Matthew O.; Vos, Tricia J.; Adams, Ruth; Alley, Jennifer; Anthony, Justin; Barrett, Cynthia; Bharathan, Indu; Bowman, Douglas; Bump, Nancy J.; Chau, Ryan; Cullis, Courtney; Driscoll, Denise L.; Elder, Amy; Forsyth, Nancy; Frazer, Jonathan; Guo, Jianping; Guo, Luyi; Hyer, Marc L.; Janowick, David; Kulkarni, Bheemashankar; Lai, Su-Jen; Lasky, Kerri; Li, Gang; Li, Jing; Liao, Debra; Little, Jeremy; Peng, Bo; Qian, Mark G.; Reynolds, Dominic J.; Rezaei, Mansoureh; Scott, Margaret Porter; Sells, Todd B.; Shinde, Vaishali; Shi, Qiuju Judy; Sintchak, Michael D.; Soucy, Francois; Sprott, Kevin T.; Stroud, Stephen G.; Nestor, Michelle; Visiers, Irache; Weatherhead, Gabriel; Ye, Yingchun; Damore, Natalie Journal of Medicinal Chemistry, 2012 , vol. 55, # 1 p. 197 - 208

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-H320
Precautionary Statements : P264-P280-P302+P352-P305+P351+P338-P362

Quality Control

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Computational Chemistry Data

  • TPSA   6.48
  • LogP   2.1965
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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