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CS-W001157 4
Total: USD 88.00

ANB-NOS

  • CAS No. 60117-35-3

  • Cat. No. CS-0115773
  • Purity≥98%
  • MDL No.MFCD00054962

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

ANB-NOS|CS-0115773

Structure of 60117-35-3

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General Information

  • CAS No. 60117-35-3
  • Cat. No. CS-0115773
  • Purity ≥98%
  • MDL No. MFCD00054962
  • Storage -20°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₇N₅O₆
  • Molecular Weight 305.21
  • Synonym(s) None
  • SMILES O=C(ON1C(CCC1=O)=O)C2=CC(N=[N+]=[N-])=CC=C2[N+]([O-])=O

Description

2,4,6-Trichloroanisole, belonging to the class of chloroanisoles, is an odorant responsible for the musty-mildew-like aroma of cork taint in bottled wines. It occurs due to contamination from the cardboard used for cork transportation, usage of hypochlorite as the cork bleaching agent, wood preservatives, biocides, fungicides, and herbicides containing pentachlorophenol, 2,3,4,6-tetrachlorophenol, 2,4,6-trichlorophenol, etc.2,4,6-Trichloroanisole solution has been used as a drinking water odor standard for the analysis of trace odor components in drinking water samples using gas chromatography coupled to mass spectrometry (GC/MS). It has also been used as certified reference material for the quantification of the analyte in red wine using gas chromatography with electron capture detection (GC-ECD).

Synthesis

  • Route1
    • In-stock
      HOSU Amino acid impurity|CS-1733141
      6066-82-6
    • null|null
      60117-34-2
    • ~%
    • In-stock
      ANB-NOS|CS-0115773
      60117-35-3

    References

    • Bernardi, Dan; Ba, Lalla Aicha; Kirsch, Gilbert Synthesis, 2007 , # 1 p. 140 - 144

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   155.58
  • LogP   1.7574
  • H_Acceptors   7
  • H_Donors   0
  • Rotatable_Bonds   4

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