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Cat. No. Size / Unit Price Qty
CS-W001157 4
Total: USD 88.00

Caffeic acid

  • CAS No. 331-39-5

  • Cat. No. CS-8205
  • Purity≥98%
  • MDL No.MFCD00004392

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

Caffeic acid|CS-8205

Structure of 331-39-5

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General Information

  • CAS No. 331-39-5
  • Cat. No. CS-8205
  • Purity ≥98%
  • MDL No. MFCD00004392
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈O₄
  • Molecular Weight 180.16
  • Synonym(s) None
  • SMILES O=C(O)/C=C/C1=CC=C(O)C(O)=C1

Description

.

Synthesis

  • Route1
    • Methyl (e)-3-(benzo[d][1,3]dioxol-5-yl)acrylate|CS-0664856
      40918-96-5
    • ~38%
    • In-stock
      Caffeic acid|CS-8205
      331-39-5

    References

    • NICHOLAS PIRAMAL INDIA LIMITED Patent: WO2008/26125 A2, 2008 ; Location in patent: Page/Page column 16 ;
  • Route2
    • In-stock
      Caftaric acid|CS-4260
      67879-58-7
    • ~%
    • null|null
      87-69-4
    • In-stock
      Caffeic acid|CS-8205
      331-39-5

    References

    • US2013/95074 A1, ; Paragraph 0089; 0090 ;
  • Route3
    • null|null
      141-82-2
    • In-stock
      Protocatechualdehyde|CS-W009195
      139-85-5
    • ~78%
    • In-stock
      Caffeic acid|CS-8205
      331-39-5

    References

    • Sampath Kumar; Subba Reddy; Thirupathi Reddy; Srinivas; Yadav Organic Preparations and Procedures International, 2000 , vol. 32, # 1 p. 81 - 83

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS08
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H351
Precautionary Statements : P280-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   77.76
  • LogP   1.1956
  • H_Acceptors   3
  • H_Donors   3
  • Rotatable_Bonds   2

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