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CS-W001157 4
Total: USD 88.00

3-Amino-4-methylbenzenesulfonic acid

  • CAS No. 618-03-1

  • Cat. No. CS-W010742
  • Purity≥97%
  • MDL No.MFCD00025204

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

3-Amino-4-methylbenzenesulfonic acid|CS-W010742

Structure of 618-03-1

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General Information

  • CAS No. 618-03-1
  • Cat. No. CS-W010742
  • Purity ≥97%
  • MDL No. MFCD00025204
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₉NO₃S
  • Molecular Weight 187.22
  • Synonym(s) Ortho toludine 4 sulphonic acid
  • SMILES O=S(O)(C1=CC=C(C)C(N)=C1)=O

Synthesis

  • Route1
    • 4-Methyl-3-nitrobenzenesulfonic acid|CS-0573374
      97-06-3
    • ~%
    • 3-Amino-4-methylbenzenesulfonic acid|CS-W010742
      618-03-1

    References

    • Justus Liebigs Annalen der Chemie, , vol. 155, p. 13 Justus Liebigs Annalen der Chemie, , vol. 172, p. 196 Zeitschrift fuer Chemie, , p. 211
  • Route2

    References

    • Justus Liebigs Annalen der Chemie, , vol. 265, p. 77 Journal of the Chemical Society, , vol. 73, p. 754
  • Route3
    • null|null
      88-72-2
    • ~%
    • 3-Amino-4-methylbenzenesulfonic acid|CS-W010742
      618-03-1

    References

    • Justus Liebigs Annalen der Chemie, , vol. 155, p. 13

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H319
Precautionary Statements : P264-P280-P305+P351+P338

Quality Control

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Computational Chemistry Data

  • TPSA   80.39
  • LogP   0.82392
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   1

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