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CS-W001157 4
Total: USD 88.00

(S)-2-(4-Butylphenyl)propanoicacid

  • CAS No. 404354-76-3

  • Cat. No. CS-0172231
  • Purity≥97%
  • MDL No.None

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

(S)-2-(4-Butylphenyl)propanoicacid|CS-0172231

Structure of 404354-76-3

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General Information

  • CAS No. 404354-76-3
  • Cat. No. CS-0172231
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₈O₂
  • Molecular Weight 206.28
  • Synonym(s) (S)-2-(4-Butylphenyl)-propionic acid
  • SMILES CCCCC1=CC=C(C=C1)[C@H](C)C(=O)O

Synthesis

  • Route1
    • null|null
      404354-75-2
    • ~54%
    • (S)-2-(4-Butylphenyl)propanoicacid|CS-0172231
      404354-76-3

    References

    • Aoki, Yoshio; Shitara, Hiroaki; Hirose, Takuji; Nohira, Hiroyuki Bulletin of the Chemical Society of Japan, 2001 , vol. 74, # 11 p. 2219 - 2222

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P304+P340-P330-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   3.2173
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   5

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