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CS-W001157 4
Total: USD 88.00

3-(Cyclohexylamino)propan-1-ol

  • CAS No. 31121-12-7

  • Cat. No. CS-0355365
  • Molecule weight157.25
  • Purity≥95%
  • MDL No.None

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

3-(Cyclohexylamino)propan-1-ol|CS-0355365

Structure of 31121-12-7

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General Information

  • CAS No. 31121-12-7
  • Cat. No. CS-0355365
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₉NO
  • Molecular Weight 157.25
  • Synonym(s) 3-(cyclohexylamino)-1-propanol
  • SMILES OCCCNC1CCCCC1

Synthesis

  • Route1
    • Methyl 3-(cyclohexylamino)propanoate|CS-0302101
      22870-26-4
    • ~63%
    • 3-(Cyclohexylamino)propan-1-ol|CS-0355365
      31121-12-7

    References

    • Banning, Joseph E.; Prosser, Anthony R.; Alnasleh, Bassam K.; Smarker, Jason; Rubina, Marina; Rubin, Michael Journal of Organic Chemistry, 2011 , vol. 76, # 10 p. 3968 - 3986
  • Route2

    References

    • Venuti, Michael C.; Jones, Gordon H.; Alvarez, Robert; Bruno, John J. Journal of Medicinal Chemistry, 1987 , vol. 30, # 2 p. 303 - 318
  • Route3
    • null|null
      108-91-8
    • null|null
      627-30-5
    • ~88%
    • 3-(Cyclohexylamino)propan-1-ol|CS-0355365
      31121-12-7

    References

    • Wagner, Barbara J.; Doi, Joyce Takahashi; Musker, W. Kenneth Journal of Organic Chemistry, 1990 , vol. 55, # 13 p. 4156 - 4162

Safety Information

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GHS Pictogram : N/A
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UN#: N/A
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Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   32.26
  • LogP   1.2911
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   4

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