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1-Hexadecyl-4-methylpyridin-1-ium chloride hydrate

  • CAS No. 13106-53-1

  • Cat. No. CS-0463059
  • Purity≥98%
  • MDL No.MFCD02093475

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

1-Hexadecyl-4-methylpyridin-1-ium chloride hydrate|CS-0463059

Structure of 13106-53-1

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General Information

  • CAS No. 13106-53-1
  • Cat. No. CS-0463059
  • Purity ≥98%
  • MDL No. MFCD02093475
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₂H₄₂ClNO
  • Molecular Weight 372.03
  • Synonym(s) Pyridinium, 1-hexadecyl-4-methyl-, chloride (1:1)
  • SMILES CCCCCCCCCCCCCCCC[N+]1=CC=C(C)C=C1.[Cl-].O

Synthesis

  • Route1

    References

    • Barni, Ermanno; Savarino, Piero; Larovere, Raffaella; Viscardi, Guido; Pelizzeti, Ezio Journal of Heterocyclic Chemistry, 1986 , vol. 23, p. 209 - 222
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    • 1-Hexadecyl-4-methylpyridin-1-ium chloride hydrate|CS-0463059
      13106-53-1

    References

    • Bulletin of the Chemical Society of Japan, , vol. 63, # 10 p. 3053 - 3055
  • Route3

    References

    • Bulletin of the Chemical Society of Japan, , vol. 63, # 10 p. 3053 - 3055

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS06,GHS09
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H302-H315-H318-H330-H335-H400
Precautionary Statements : P260-P261-P264-P270-P271-P273-P280-P284-P302+P352-P304+P340-P330-P362+P364-P391-P405-P501

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Computational Chemistry Data

  • TPSA   35.38
  • LogP   2.94312
  • H_Acceptors   0
  • H_Donors   0
  • Rotatable_Bonds   15

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