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CS-W001157 4
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5-Amino-2-methylbenzoic acid

  • CAS No. 2840-04-2

  • Cat. No. CS-W003272
  • Purity≥97%
  • MDL No.None

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

5-Amino-2-methylbenzoic acid|CS-W003272

Structure of 2840-04-2

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General Information

  • CAS No. 2840-04-2
  • Cat. No. CS-W003272
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₉NO₂
  • Molecular Weight 151.16
  • Synonym(s) 5-Amino-o-toluic Acid
  • SMILES Nc1ccc(c(c1)C(=O)O)C

Description

5-Amino-2-methylbenzoic acid features a conjugated aromatic core bearing an electron-rich amino group and a sterically accessible methyl substituent. This combination enables facile derivatization in synthetic organic chemistry, particularly in the development of functionalized scaffolds for pharmaceutical intermediates and bioactive molecule design under standard bench conditions.

Synthesis

  • Route1

    References

    • Ashton, Michael J.; Brown, Thomas J.; Fenton, Garry; Halley, Frank; Harper, Mark F.; Lockey, Peter M.; Porter, Barry; Roach, Alan G.; Stuttle, Keith A. J.; Vicker, Nigel; Walsh, Roger J. A. Journal of Medicinal Chemistry, 1996 , vol. 39, # 17 p. 3343 - 3356
  • Route2

    References

    • Recueil des Travaux Chimiques des Pays-Bas, , vol. 42, p. 37
  • Route3

    References

    • Recueil des Travaux Chimiques des Pays-Bas, , vol. 42, p. 37

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-P405-P501

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Computational Chemistry Data

  • TPSA   63.32
  • LogP   1.27542
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   1

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