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CS-W001157 4
Total: USD 88.00

1,4,5-Trimethylnaphthalene

  • CAS No. 2131-41-1

  • Cat. No. CS-0336455
  • Purity≥96%
  • MDL No.None

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

1,4,5-Trimethylnaphthalene|CS-0336455

Structure of 2131-41-1

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General Information

  • CAS No. 2131-41-1
  • Cat. No. CS-0336455
  • Purity ≥96%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₄
  • Molecular Weight 170.25
  • Synonym(s) 1,4,5-Trimethyl naphthalene
  • SMILES CC1=CC=C(C)C2=C(C)C=CC=C12

Synthesis

  • Route1

    References

    • Ried; Bodem Chemische Berichte, 1958 , vol. 91, p. 1354
  • Route2

    References

    • Listvan, V. N.; Stasyuk, A. P. Journal of Organic Chemistry USSR (English Translation), 1985 , vol. 21, # 2 p. 354 - 359 Zhurnal Organicheskoi Khimii, 1985 , vol. 21, # 2 p. 392 - 398
  • Route3
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    • ~%
    • 1,4,5-Trimethylnaphthalene|CS-0336455
      2131-41-1

    References

    • Eisenbraun,E.J. et al. Journal of Organic Chemistry, 1971 , vol. 36, # 17 p. 2480 - 2485

Safety Information

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

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Computational Chemistry Data

  • TPSA   0
  • LogP   3.76506
  • H_Acceptors   0
  • H_Donors   0
  • Rotatable_Bonds   0

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