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CS-W001157 4
Total: USD 88.00

2-(1,1-dioxidothiomorpholino)-3-phenylpropanoic acid

  • CAS No. 100610-68-2

  • Cat. No. CS-0034358
  • Purity≥98%
  • MDL No.None

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

2-(1,1-dioxidothiomorpholino)-3-phenylpropanoic acid|CS-0034358

Structure of 100610-68-2

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General Information

  • CAS No. 100610-68-2
  • Cat. No. CS-0034358
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₇NO₄S
  • Molecular Weight 283.34
  • Synonym(s) 2-(1,1-DIOXO-1LAMBDA6,4-THIAZINAN-4-YL)-3-PHENYLPROPANOIC ACID
  • SMILES OC(C(N1CCS(CC1)(=O)=O)CC2=CC=CC=C2)=O

Synthesis

  • Route1
    • 1-Chloro-2-(2-chloroethanesulfonyl)ethane|CS-0256520
      471-03-4
    • L-Phenylalanine Aspartame Impurity|CS-0229723
      63-91-2
    • ~%
    • 2-(1,1-dioxidothiomorpholino)-3-phenylpropanoic acid|CS-0034358
      100610-68-2

    References

    • Journal of the Chemical Society, , p. 2433,2440
  • Route2
    • null|null
      77-77-0
    • L-Phenylalanine Aspartame Impurity|CS-0229723
      63-91-2
    • ~%
    • 2-(1,1-dioxidothiomorpholino)-3-phenylpropanoic acid|CS-0034358
      100610-68-2

    References

    • Journal of the Chemical Society, , p. 2433,2440

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   74.68
  • LogP   0.4127
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   4

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