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CS-W001157 4
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3-((1-Acetylindolin-5-yl)sulfonyl)propanoic acid

  • CAS No. 841275-85-2

  • Cat. No. CS-0359370
  • Molecule weight297.33
  • Purity95+%
  • MDL No.None

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

3-((1-Acetylindolin-5-yl)sulfonyl)propanoic acid|CS-0359370

Structure of 841275-85-2

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General Information

  • CAS No. 841275-85-2
  • Cat. No. CS-0359370
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₅NO₅S
  • Molecular Weight 297.33
  • Synonym(s) 3-[(1-acetyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]propanoic acid
  • SMILES CC(=O)N1CCC2=CC(=CC=C21)S(=O)(=O)CCC(=O)O

Synthesis

  • Route1

    References

    • Dorogov, Mikhail V.; Filimonov, Sergey I.; Kobylinsky, Dmitry B.; Ivanovsky, Sergey A.; Korikov, Pavel V.; Soloviev, Mikhail Y.; Khahina, Maria Y.; Shalygina, Elena E.; Kravchenko, Dmitry V.; Ivachtchenko, Alexandre V. Synthesis, 2004 , # 18 p. 2999 - 3004
  • Route2

    References

    • Dorogov, Mikhail V.; Filimonov, Sergey I.; Kobylinsky, Dmitry B.; Ivanovsky, Sergey A.; Korikov, Pavel V.; Soloviev, Mikhail Y.; Khahina, Maria Y.; Shalygina, Elena E.; Kravchenko, Dmitry V.; Ivachtchenko, Alexandre V. Synthesis, 2004 , # 18 p. 2999 - 3004

Safety Information

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GHS Pictogram : N/A
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UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   91.75
  • LogP   0.844
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   4

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