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CS-W001157 4
Total: USD 88.00

Ethyl 3-aminobenzoate

  • CAS No. 582-33-2

  • Cat. No. CS-B1378
  • Purity≥98%
  • MDL No.MFCD00007794

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

Ethyl 3-aminobenzoate|CS-B1378

Structure of 582-33-2

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General Information

  • CAS No. 582-33-2
  • Cat. No. CS-B1378
  • Purity ≥98%
  • MDL No. MFCD00007794
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₁NO₂
  • Molecular Weight 165.19
  • Synonym(s) Ethyl 3-aminobenzoate,(3-Aminobenzoic acid ethyl ester)
  • SMILES O=C(OCC)C1=CC(N)=CC=C1

Synthesis

  • Route1

    References

    • Hosangadi, Bhaskar D.; Dave, Rajesh H. Tetrahedron Letters, 1996 , vol. 37, # 35 p. 6375 - 6378
  • Route2

    References

    • Maejima, Toshihide; Shimoda, Yutaka; Nozaki, Kei; Mori, Shigeki; Sawama, Yoshinari; Monguchi, Yasunari; Sajiki, Hironao Tetrahedron, 2012 , vol. 68, # 6 p. 1712 - 1722
  • Route3

    References

    • Bhuiyan, M. Delower H.; Zhu, Kai-Xian; Jensen, Paul; Try, Andrew C. European Journal of Organic Chemistry, 2010 , # 24 p. 4662 - 4670

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   52.32
  • LogP   1.4455
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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