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CS-W001157 4
Total: USD 88.00

N1-Benzylpropane-1,3-diamine

  • CAS No. 13910-48-0

  • Cat. No. CS-W022916
  • Purity≥97%
  • MDL No.MFCD00274361

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

N1-Benzylpropane-1,3-diamine|CS-W022916

Structure of 13910-48-0

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General Information

  • CAS No. 13910-48-0
  • Cat. No. CS-W022916
  • Purity ≥97%
  • MDL No. MFCD00274361
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₆N₂
  • Molecular Weight None
  • Synonym(s) N-Benzyltrimethylenediamine
  • SMILES NCCCNCC1=CC=CC=C1

Description

N1-Benzylpropane-1,3-diamine features a benzyl-substituted primary amine at the N1 position of a propane-1,3-diamine scaffold. This configuration enhances solubility and electronic modulation in synthetic applications. The molecule integrates readily into ligand architectures and serves as a key building block for chelating agents and functionalized polymers under standard conditions.

Application

N1-Benzylpropane-1,3-diamine serves as a versatile bifunctional building block in medicinal chemistry and catalysis. The primary amine at C1 enables facile derivatization, while the benzyl group imparts enhanced solubility and metabolic stability. It functions effectively in ligand design for transition metal catalysts and as a scaffold for heterocyclic ring formation via cyclization reactions. Bench-stable and readily purified by standard techniques, it supports scalable synthesis of bioactive molecules and functional materials.

Synthesis

  • Route1

    References

    • Bergeron; Garlich Synthesis, 1984 , vol. NO. 9, p. 782 - 784
  • Route2
    • null|null
      100-52-7
    • null|null
      107-15-3
    • ~30%
    • In-stock
      N1-Benzylpropane-1,3-diamine|CS-W022916
      13910-48-0

    References

    • Milelli, Andrea; Tumiatti, Vincenzo; Micco, Marialuisa; Rosini, Michela; Zuccari, Guendalina; Raffaghello, Lizzia; Bianchi, Giovanna; Pistoia, Vito; Fernando Diaz; Pera, Benet; Trigili, Chiara; Barasoain, Isabel; Musetti, Caterina; Toniolo, Marianna; Sissi, Claudia; Alcaro, Stefano; Moraca, Federica; Zini, Maddalena; Stefanelli, Claudio; Minarini, Anna European Journal of Medicinal Chemistry, 2012 , vol. 57, p. 417 - 428
  • Route3
    • null|null
      109-76-2
    • In-stock
      N-Methyl-1-phenylmethanamine|CS-0226149
      103-67-3
    • ~21%
    • 2-Phenyl-1,4,5,6-tetrahydropyrimidine|CS-0267426
      25099-77-8
    • In-stock
      N1-Benzylpropane-1,3-diamine|CS-W022916
      13910-48-0
    • null|null
      74-89-5

    References

    • Journal of the American Chemical Society, , vol. 105, # 15 p. 5002 - 5011

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 2735
Class : 8
Packing Group : Ⅲ
Hazard Statements : H314-H318
Precautionary Statements : P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   38.05
  • LogP   1.125
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   5

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