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CS-W001157 4
Total: USD 88.00

2-Aminophenyl 4-methylbenzene-1-sulfonate

  • CAS No. 1216-96-2

  • Cat. No. CS-0127125
  • Molecule weight263.31
  • Purity≥98%
  • MDL No.MFCD08277613

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

2-Aminophenyl 4-methylbenzene-1-sulfonate|CS-0127125

Structure of 1216-96-2

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General Information

  • CAS No. 1216-96-2
  • Cat. No. CS-0127125
  • Purity ≥98%
  • MDL No. MFCD08277613
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₃NO₃S
  • Molecular Weight 263.31
  • Synonym(s) TOLUENE-4-SULFONIC ACID 2-AMINO-PHENYL ESTER
  • SMILES O=S(C1=CC=C(C)C=C1)(OC2=CC=CC=C2N)=O

Synthesis

  • Route1
    • null|null
      95-55-6
    • null|null
      98-59-9
    • ~98%
    • 2-Aminophenyl 4-methylbenzene-1-sulfonate|CS-0127125
      1216-96-2

    References

    • Bae, Sung Jin; Ha, Young Mi; Kim, Jin-Ah; Park, Ji Young; Ha, Tae Kwun; Park, Daeui; Chun, Pusoon; Park, Nam Hee; Moon, Hyung Ryong; Chung, Hae Young Bioscience, Biotechnology and Biochemistry, 2013 , vol. 77, # 1 p. 65 - 72
  • Route2
    • null|null
      1095280-67-3
    • ~89%
    • 2-Aminophenyl 4-methylbenzene-1-sulfonate|CS-0127125
      1216-96-2

    References

    • Porzelle, Achim; Woodrow, Michael D.; Tomkinson, Nicholas C. O. European Journal of Organic Chemistry, 2008 , # 30 p. 5135 - 5143
  • Route3
    • 2-Nitrophenyl 4-methylbenzenesulfonate|CS-1139667
      1226-48-8
    • ~%
    • 2-Aminophenyl 4-methylbenzene-1-sulfonate|CS-0127125
      1216-96-2

    References

    • Downer-Riley, Nadale K.; Jackson, Yvette A. Tetrahedron, 2007 , vol. 63, # 41 p. 10276 - 10281

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   69.39
  • LogP   2.34492
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   3

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