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CS-W001157 4
Total: USD 88.00

3-(4-Nitrophenoxy)propan-1-amine

  • CAS No. 100841-04-1

  • Cat. No. CS-0439711
  • Molecule weight196.20
  • Purity≥98%
  • MDL No.None

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

3-(4-Nitrophenoxy)propan-1-amine|CS-0439711

Structure of 100841-04-1

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General Information

  • CAS No. 100841-04-1
  • Cat. No. CS-0439711
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₂N₂O₃
  • Molecular Weight 196.20
  • Synonym(s) 3-(4-Nitrophenoxy)propylamine
  • SMILES C(CN)COC1=CC=C(C=C1)[N+](=O)[O-]

Synthesis

  • Route1
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      904-10-9
    • ~%
    • 3-(4-Nitrophenoxy)propan-1-amine|CS-0439711
      100841-04-1

    References

    • Lever Jr.; Bell; Hyman; McGuire; Ferone Journal of Medicinal Chemistry, 1986 , vol. 29, # 5 p. 665 - 670
  • Route2
    • null|null
      100-02-7
    • ~%
    • 3-(4-Nitrophenoxy)propan-1-amine|CS-0439711
      100841-04-1

    References

    • Lever Jr.; Bell; Hyman; McGuire; Ferone Journal of Medicinal Chemistry, 1986 , vol. 29, # 5 p. 665 - 670
  • Route3
    • 4-(4-Nitrophenoxy)butanoic acid|CS-0036281
      28341-54-0
    • ~%
    • 3-(4-Nitrophenoxy)propan-1-amine|CS-0439711
      100841-04-1

    References

    • Ishidate et al. Yakugaku Zasshi, 1952 , vol. 72, p. 88,89 Chem.Abstr., 1952 , p. 6192

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   78.39
  • LogP   1.3224
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   5

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