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CS-W001157 4
Total: USD 88.00

1-(2-Amino-5-methylphenyl)-2-chloroethan-1-one

  • CAS No. 61871-80-5

  • Cat. No. CS-0572936
  • Molecule weight183.63
  • Purity≥98%
  • MDL No.None

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

1-(2-Amino-5-methylphenyl)-2-chloroethan-1-one|CS-0572936

Structure of 61871-80-5

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General Information

  • CAS No. 61871-80-5
  • Cat. No. CS-0572936
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀ClNO
  • Molecular Weight 183.63
  • Synonym(s) Ethanone, 1-(2-amino-5-methylphenyl)-2-chloro- (9CI)
  • SMILES CC1=CC(=C(C=C1)N)C(=O)CCl

Synthesis

  • Route1
    • null|null
      106-49-0
    • null|null
      107-14-2
    • ~60%
    • 1-(2-Amino-5-methylphenyl)-2-chloroethan-1-one|CS-0572936
      61871-80-5

    References

    • Nimtz, Manfred; Haefelinger, Guenter Liebigs Annalen der Chemie, 1987 , p. 765 - 770
  • Route2

    References

    • Kunckell Chemische Berichte, 1900 , vol. 33, p. 2647,2649 Chem. Zentralbl., 1900 , vol. 71, # I p. 240

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06,GHS08
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H311-H331-H341
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   43.09
  • LogP   1.99872
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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