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CS-W001157 4
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(S)-1-(benzylamino)-3-(benzyloxy)propan-2-ol

  • CAS No. 205242-64-4

  • Cat. No. CS-M1090
  • Molecule weight271.35
  • Purity≥95%
  • MDL No.None

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

(S)-1-(benzylamino)-3-(benzyloxy)propan-2-ol|CS-M1090

Structure of 205242-64-4

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General Information

  • CAS No. 205242-64-4
  • Cat. No. CS-M1090
  • Purity ≥95%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₇H₂₁NO₂
  • Molecular Weight 271.35
  • Synonym(s) (S)-2-Isothiocyanatoheptane
  • SMILES O[C@H](COCC1=CC=CC=C1)CNCC2=CC=CC=C2

Synthesis

  • Route1
    • In-stock
      (R)-2-((Benzyloxy)methyl)oxirane|CS-B1359
      14618-80-5
    • null|null
      100-46-9
    • ~67%
    • In-stock
      (S)-1-(benzylamino)-3-(benzyloxy)propan-2-ol|CS-M1090
      205242-64-4

    References

    • Berg, Stefan; Larsson, Lars-Gunnar; Renyi, Lucy; Ross, Svante B.; Thorberg, Seth-Olof; Thorell-Svantesson, Gun Journal of Medicinal Chemistry, 1998 , vol. 41, # 11 p. 1934 - 1942

Safety Information

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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   41.49
  • LogP   2.3539
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   8

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