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CS-W001157 4
Total: USD 88.00

1-(2-Amino-3-methylphenyl)ethanone

  • CAS No. 53657-94-6

  • Cat. No. CS-0061143
  • Molecule weight149.19
  • Purity95+%
  • MDL No.None

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

1-(2-Amino-3-methylphenyl)ethanone|CS-0061143

Structure of 53657-94-6

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General Information

  • CAS No. 53657-94-6
  • Cat. No. CS-0061143
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₁NO
  • Molecular Weight 149.19
  • Synonym(s) Ethanone, 1-(2-amino-3-methylphenyl)- (9CI)
  • SMILES CC1=C(C(=CC=C1)C(=O)C)N

Synthesis

  • Route1
    • null|null
      75-05-8
    • null|null
      95-53-4
    • ~39%
    • 1-(2-Amino-3-methylphenyl)ethanone|CS-0061143
      53657-94-6

    References

    • Tabuchi, Seiichiro; Ito, Harunobu; Sogabe, Hajime; Kuno, Masako; Kinoshita, Takayoshi; Katumi, Ikuyo; Yamamoto, Naoko; Mitsui, Hitoshi; Satoh, Yoshinari Chemical and Pharmaceutical Bulletin, 2000 , vol. 48, # 1 p. 1 - 15
  • Route2
    • null|null
      1336-21-6
    • null|null
      56762-31-3
    • ~%
    • 1-(2-Amino-3-methylphenyl)ethanone|CS-0061143
      53657-94-6

    References

    • Chevron Research Company Patent: US4244730 A1, 1981 ;
  • Route3

    References

    • Mangas-Sanchez, Juan; Busto, Eduardo; Gotor-Fernandez, Vicente; Gotor, Vicente Organic Letters, 2012 , vol. 14, # 6 p. 1444 - 1447

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

Quality Control

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Computational Chemistry Data

  • TPSA   43.09
  • LogP   1.77982
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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