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CS-W001157 4
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1-EBIO

  • CAS No. 10045-45-1

  • Cat. No. CS-0021217
  • Molecule weight162.19
  • Purity≥98%
  • MDL No.MFCD00005715

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

1-EBIO|CS-0021217

Structure of 10045-45-1

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General Information

  • CAS No. 10045-45-1
  • Cat. No. CS-0021217
  • Purity ≥98%
  • MDL No. MFCD00005715
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀N₂O
  • Molecular Weight 162.19
  • Synonym(s) 1-Ethyl-2-benzimidazolinone
  • SMILES O=C1NC2=CC=CC=C2N1CC

Description

Ninhydrin is an important building block in organic synthesis and has been employed to prepare a variety of chemicals for complexing and/or sensing metal ions. It is an amino acid-sensitive reagent used for the preparation of Ruhemanns purple.Ninhydrin can be used:For the detection of free amino groups in amino acids, peptides, and proteins.As a ligand for the Cu-catalyzed N-arylation of nitrogen-containing heterocycles with aryl and heteroaryl halides to synthesize N-arylheterocycles.As a reactant to synthesize aldols by reacting with active methylene compounds.

Synthesis

  • Route1
    • In-stock
      N1-Ethylbenzene-1,2-diamine|CS-0151974
      23838-73-5
    • null|null
      530-62-1
    • ~%
    • In-stock
      1-EBIO|CS-0021217
      10045-45-1

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 18, # 23 p. 6067 - 6070
  • Route2
    • null|null
      74375-44-3
    • ~78%
    • In-stock
      1-EBIO|CS-0021217
      10045-45-1

    References

    • Liu, Peng; Wang, Zhiming; Hu, Xianming European Journal of Organic Chemistry, 2012 , # 10 p. 1994 - 2000
  • Route3
    • null|null
      77556-92-4
    • ~96%
    • In-stock
      1-EBIO|CS-0021217
      10045-45-1

    References

    • Vernin, Gaston; Domlog, Hicham; Siv, Chan; Metzger, Jaques; El-Shafei, Ahmed Kamal Journal of Heterocyclic Chemistry, 1981 , vol. 18, p. 85 - 89

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-H319
Precautionary Statements : P264-P270-P280-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   37.79
  • LogP   1.3495
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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