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CS-W001157 4
Total: USD 88.00

Methyl 2-(methoxymethyl)benzoate

  • CAS No. 942-57-4

  • Cat. No. CS-0195946
  • Purity≥98%
  • MDL No.None

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

Methyl 2-(methoxymethyl)benzoate|CS-0195946

Structure of 942-57-4

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General Information

  • CAS No. 942-57-4
  • Cat. No. CS-0195946
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₂O₃
  • Molecular Weight 180.20
  • Synonym(s) Benzoic acid, 2-(methoxymethyl)-, methyl ester
  • SMILES O=C(OC)C1=CC=CC=C1COC

Synthesis

  • Route1

    References

    • Hori, Mikio; Kataoka, Tadashi; Shimizu, Hiroshi; Tsutsumi, Kazuhiro Journal of Organic Chemistry, 1987 , vol. 52, # 8 p. 1397 - 1400
  • Route2

    References

    • Rudenko, A. P.; Korovina, N. S. Russian Journal of Organic Chemistry, 1995 , vol. 31, # 8 p. 1084 - 1088 Zhurnal Organicheskoi Khimii, 1995 , vol. 31, # 8 p. 1191 - 1196
  • Route3

    References

    • Kozlov, Maxim V.; Kleymenova, Alla A.; Romanova, Lyudmila I.; Konduktorov, Konstantin A.; Smirnova, Olga A.; Prasolov, Vladimir S.; Kochetkov, Sergey N. Bioorganic and Medicinal Chemistry Letters, 2013 , vol. 23, # 21 p. 5936 - 5940

Safety Information

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GHS Pictogram : N/A
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UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   35.53
  • LogP   1.6196
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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