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CS-W001157 4
Total: USD 88.00

2-[(4-Methyl-2-nitrophenyl)amino]ethanol

  • CAS No. 100418-33-5

  • Cat. No. CS-0208760
  • Molecule weight196.20
  • Purity≥98%
  • MDL No.MFCD00274758

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

2-[(4-Methyl-2-nitrophenyl)amino]ethanol|CS-0208760

Structure of 100418-33-5

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General Information

  • CAS No. 100418-33-5
  • Cat. No. CS-0208760
  • Purity ≥98%
  • MDL No. MFCD00274758
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₂N₂O₃
  • Molecular Weight 196.20
  • Synonym(s) N-(beta-Hydroxyethyl)-2-nitro-p-toluidine
  • SMILES CC1=CC(=C(C=C1)NCCO)[N+](=O)[O-]

Synthesis

  • Route1

    References

    • Hoang, Hung; LaBarbera, Daniel V.; Mohammed, Kaleem A.; Ireland, Chris M.; Skibo, Edward B. Journal of Medicinal Chemistry, 2007 , vol. 50, # 19 p. 4561 - 4571
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    References

    • LaBarbera, Daniel V.; Skibo, Edward B. Bioorganic and Medicinal Chemistry, 2005 , vol. 13, # 2 p. 387 - 395
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    • 2-[(4-Methyl-2-nitrophenyl)amino]ethanol|CS-0208760
      100418-33-5

    References

    • Yakugaku Zasshi, , vol. 63, p. 370,372 Chem.Abstr., , p. 2876

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   75.4
  • LogP   1.30742
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   4

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