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2-chloro-4,6-dimethoxybenzaldehyde

  • CAS No. 82477-61-0

  • Cat. No. CS-0038443
  • Purity≥97%
  • MDL No.None

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

2-chloro-4,6-dimethoxybenzaldehyde|CS-0038443

Structure of 82477-61-0

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General Information

  • CAS No. 82477-61-0
  • Cat. No. CS-0038443
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉ClO₃
  • Molecular Weight 200.62
  • Synonym(s) 2-CHLORO-4,6-DIMEHOXYBENZALDEHYDE
  • SMILES COC1=CC(=C(C=O)C(=C1)OC)Cl

Synthesis

  • Route1

    References

    • ANACOR PHARMACEUTICALS, INC.; GLAXOSMITHKINE LLC; XIA, Yi; ALLEY, Michael, Richard Kevin; ZHOU, Yasheen; SINGH, Rajeshwar; DING, Charles; CAO, Kathy; PLATTNER, Jacob, J.; OU, Ligong; JIA, Guofeng; SARASWAT, Neerja; RAMACHANDRAN, Sreekanth; ZHOU, Ding Patent: WO2011/17125 A1, 2011 ; Location in patent: Page/Page column 113 ;
  • Route2

    References

    • Gallardo-Godoy, Alejandra; Fierro, Angelica; McLean, Thomas H.; Castillo, Mariano; Cassels, Bruce K.; Reyes-Parada, Miguel; Nichols, David E. Journal of Medicinal Chemistry, 2005 , vol. 48, # 7 p. 2407 - 2419
  • Route3
    • 4-(Hydroxyimino)cyclohexa-2,5-dien-1-one|CS-0366469
      637-62-7
    • ~%
    • 2-chloro-4,6-dimethoxybenzaldehyde|CS-0038443
      82477-61-0

    References

    • Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), , p. 1095 - 1098

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-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P501

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Computational Chemistry Data

  • TPSA   35.53
  • LogP   2.1697
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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