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CS-W001157 4
Total: USD 88.00

2-(3-(Carboxymethyl)-4-(phenylthio)phenyl)propanoic acid

  • CAS No. 83237-49-4

  • Cat. No. CS-0456059
  • Molecule weight316.37
  • Purity≥98%
  • MDL No.None

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

2-(3-(Carboxymethyl)-4-(phenylthio)phenyl)propanoic acid|CS-0456059

Structure of 83237-49-4

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General Information

  • CAS No. 83237-49-4
  • Cat. No. CS-0456059
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₇H₁₆O₄S
  • Molecular Weight 316.37
  • Synonym(s) 5-(1-Carboxyethyl)-2-(phenylthio)phenylacetic acid
  • SMILES CC(C1=CC(=C(C=C1)SC2=CC=CC=C2)CC(=O)O)C(=O)O

Synthesis

  • Route1
    • null|null
      203519-04-4
    • null|null
      108-98-5
    • ~41%
    • In-stock
      2-(3-(Carboxymethyl)-4-(phenylthio)phenyl)propanoic acid|CS-0456059
      83237-49-4

    References

    • Nippon Chemiphar Co., Ltd.; Ube Industries, Ltd. Patent: US6111115 A1, 2000 ;
  • Route2
    • null|null
      203519-12-4
    • null|null
      108-98-5
    • ~48%
    • In-stock
      2-(3-(Carboxymethyl)-4-(phenylthio)phenyl)propanoic acid|CS-0456059
      83237-49-4

    References

    • Nippon Chemiphar Co., Ltd.; Ube Industries, Ltd. Patent: US6111115 A1, 2000 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H317-H319
Precautionary Statements : P261-P264-P272-P280-P302+P352-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   74.6
  • LogP   3.653
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   6

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