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CS-W001157 4
Total: USD 88.00

2-Chloro-4,6-dimethylphenol

  • CAS No. 6641-04-9

  • Cat. No. CS-0191181
  • Molecule weight156.61
  • Purity≥98%
  • MDL No.None

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

2-Chloro-4,6-dimethylphenol|CS-0191181

Structure of 6641-04-9

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General Information

  • CAS No. 6641-04-9
  • Cat. No. CS-0191181
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₉ClO
  • Molecular Weight 156.61
  • Synonym(s) None
  • SMILES OC1=C(C)C=C(C)C=C1Cl

Synthesis

  • Route1
    • null|null
      105-67-9
    • ~83%
    • 2-Chloro-4,6-dimethylphenol|CS-0191181
      6641-04-9

    References

    • Barluenga, Jose; Jimenez-Aquino, Agustin; Aznar, Fernando; Valdes, Carlos Journal of the American Chemical Society, 2009 , vol. 131, p. 4031 - 4041
  • Route2
    • null|null
      105-67-9
    • ~%
    • null|null
      70264-63-0
    • 2-Chloro-4,6-dimethylphenol|CS-0191181
      6641-04-9
    • null|null
      85033-98-3

    References

    • Bergquist, Karl-Erik; Nilsson, Anders; Ronlan, Alvin Acta Chemica Scandinavica, Series B: Organic Chemistry and Biochemistry, 1982 , vol. 36, # 10 p. 675 - 684
  • Route3

    References

    • Bamberger; Reber Chemische Berichte, 1907 , vol. 40, p. 2268

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   20.23
  • LogP   2.66244
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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