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CS-W001157 4
Total: USD 88.00

3-((Dimethylamino)methyl)-5-methylhexan-2-one

  • CAS No. 91342-74-4

  • Cat. No. CS-0023418
  • Molecule weight171.28
  • Purity≥97%
  • MDL No.MFCD22683881

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

3-((Dimethylamino)methyl)-5-methylhexan-2-one|CS-0023418

Structure of 91342-74-4

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General Information

  • CAS No. 91342-74-4
  • Cat. No. CS-0023418
  • Purity ≥97%
  • MDL No. MFCD22683881
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₂₁NO
  • Molecular Weight 171.28
  • Synonym(s) 3-[(Dimethyamino) methyl]-5-methyl-2-hexanone
  • SMILES CC(C(CN(C)C)CC(C)C)=O

Synthesis

  • Route1
    • null|null
      50-00-0
    • null|null
      506-59-2
    • null|null
      110-12-3
    • ~58%
    • In-stock
      3-((Dimethylamino)methyl)-5-methylhexan-2-one|CS-0023418
      91342-74-4

    References

    • AUSPEX PHARMACEUTICAL ,INC.; GANT, Thomas, G.; SHAHBAZ, Manoucherhr Patent: WO2010/44981 A2, 2010 ; Location in patent: Page/Page column 28 ;
  • Route2
    • null|null
      86497-40-7
    • In-stock
      N,N-Dimethylmethyleneammonium iodide|CS-0132319
      33797-51-2
    • ~46%
    • In-stock
      3-((Dimethylamino)methyl)-5-methylhexan-2-one|CS-0023418
      91342-74-4

    References

    • AUSPEX PHARMACEUTICAL, INC.; GANT, Thomas, G.; ZHANG, Chengzhi; SHAHBAZ, Manouchehr Patent: WO2011/153157 A2, 2011 ; Location in patent: Page/Page column 44 ; WO 2011/153157 A2
  • Route3
    • null|null
      50-00-0
    • null|null
      110-12-3
    • null|null
      124-40-3
    • ~%
    • In-stock
      3-((Dimethylamino)methyl)-5-methylhexan-2-one|CS-0023418
      91342-74-4

    References

    • Liu, Chunyi; Chen, Zhengping; Li, Xiaomin; Tang, Jie; Qin, Xiaofeng Chirality, 2013 , vol. 25, # 4 p. 215 - 223

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 : P261-P264-P271-P280-P302+P352-P304+P340-P362-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   20.31
  • LogP   1.7993
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   5

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