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CS-W001157 4
Total: USD 88.00

Trans-Anethole

  • CAS No. 4180-23-8

  • Cat. No. CS-W020065
  • Purity≥98%
  • MDL No.MFCD00009284

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

Trans-Anethole|CS-W020065

Structure of 4180-23-8

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General Information

  • CAS No. 4180-23-8
  • Cat. No. CS-W020065
  • Purity ≥98%
  • MDL No. MFCD00009284
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₂O
  • Molecular Weight None
  • Synonym(s) (E)​-Anethole
  • SMILES COC1=CC=C(/C=C/C)C=C1

Description

trans-Anethole is the chief component of several essential oils including star anise, anise seed oil and sweet fennel. It is a commercial flavor substance in baked goods, candy,ice cream, chewing gum, and alcoholic beverages.trans-Anethole was used as carbon and energy supplement in the culture media of Pseudomonas putida strain, JYR-1 .

Synthesis

  • Route1
    • 4-Methoxybenzaldehyde, ≥ 99% GC|CS-0676496
      123-11-5
    • null|null
      123-38-6
    • ~48%
    • In-stock
      Trans-Anethole|CS-W020065
      4180-23-8

    References

    • COUNCIL OF SCIENTIFIC and INDUSTRIAL RESEARCH; BORATE, Hanumant, Bapurao; GAIKWAD, Supriya, Hanumant; KUDALE, Ananda, Shahaji; CHAVAN, Subhash, Prataprao; PHARANDE, Shrikant, Ganpat; WAGH, Vitthal, Dattatraya; SAWANT, Vikram, Shahaji Patent: WO2014/73003 A1, 2014 ; Location in patent: Page/Page column 12-13 ;
  • Route2

    References

    • Abu-Reziq, Raed; Avnir, David; Blum, Jochanan European Journal of Organic Chemistry, 2005 , # 17 p. 3640 - 3642
  • Route3

    References

    • Yu, Jinquan; Gaunt, Matthew J.; Spencer, Jonathan B. Journal of Organic Chemistry, 2002 , vol. 67, # 13 p. 4627 - 4629

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07,GHS09
Signal Word : Warning
UN#: 3082
Class : 9
Packing Group : Ⅲ
Hazard Statements : H303-H317-H411
Precautionary Statements : P261-P272-P273-P280-P302+P352-P312-P362+P364-P391-P501

Quality Control

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Computational Chemistry Data

  • TPSA   9.23
  • LogP   2.7283
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   2

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