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CS-W001157 4
Total: USD 88.00

(1,3-Benzoxazol-2-ylthio)acetic acid

  • CAS No. 58089-32-0

  • Cat. No. CS-0071768
  • Purity≥98%
  • MDL No.MFCD00463910

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

(1,3-Benzoxazol-2-ylthio)acetic acid|CS-0071768

Structure of 58089-32-0

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General Information

  • CAS No. 58089-32-0
  • Cat. No. CS-0071768
  • Purity ≥98%
  • MDL No. MFCD00463910
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇NO₃S
  • Molecular Weight 209.22
  • Synonym(s) (1,3-benzoxazol-2-ylsulfanyl)acetic acid
  • SMILES O=C(O)CSC1=NC(C=CC=C2)=C2O1

Synthesis

  • Route1
    • null|null
      79-11-8
    • In-stock
      Benzo[d]oxazole-2(3H)-thione|CS-W018116
      2382-96-9
    • ~75%
    • In-stock
      (1,3-Benzoxazol-2-ylthio)acetic acid|CS-0071768
      58089-32-0

    References

    • Bakhareva; Voronkov; Sorokin; Lopyrev; Seredenin; Gaidarov Pharmaceutical Chemistry Journal, 1996 , vol. 30, # 2 p. 89 - 91
  • Route2
    • null|null
      15091-70-0
    • ~%
    • In-stock
      (1,3-Benzoxazol-2-ylthio)acetic acid|CS-0071768
      58089-32-0

    References

    • Pharmazie, , vol. 54, # 3 p. 229 - 231
  • Route3
    • In-stock
      Benzo[d]oxazole-2(3H)-thione|CS-W018116
      2382-96-9
    • null|null
      79-11-8
    • ~%
    • In-stock
      (1,3-Benzoxazol-2-ylthio)acetic acid|CS-0071768
      58089-32-0

    References

    • Bollettino chimico farmaceutico, , vol. 111, # 7 p. 409 - 416

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   63.33
  • LogP   2.0045
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   3

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