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CS-W001157 4
Total: USD 88.00

Methyl 4-(diethylcarbamoyl)benzoate

  • CAS No. 122357-96-4

  • Cat. No. CS-0207825
  • Molecule weight235.28
  • Purity≥98%
  • MDL No.MFCD09418544

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

Methyl 4-(diethylcarbamoyl)benzoate|CS-0207825

Structure of 122357-96-4

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General Information

  • CAS No. 122357-96-4
  • Cat. No. CS-0207825
  • Purity ≥98%
  • MDL No. MFCD09418544
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₇NO₃
  • Molecular Weight 235.28
  • Synonym(s) Benzoic acid, 4-[(diethylamino)carbonyl]-, methyl ester
  • SMILES CCN(CC)C(=O)C1=CC=C(C=C1)C(=O)OC

Synthesis

  • Route1
    • null|null
      79-37-8
    • In-stock
      4-(Methoxycarbonyl)benzoic acid|CS-W017217
      1679-64-7
    • null|null
      109-89-7
    • ~%
    • Methyl 4-(diethylcarbamoyl)benzoate|CS-0207825
      122357-96-4

    References

    • Toyama Chemical Co., Ltd. Patent: US6384065 B1, 2002 ;
  • Route2
    • null|null
      7377-26-6
    • null|null
      109-89-7
    • ~%
    • Methyl 4-(diethylcarbamoyl)benzoate|CS-0207825
      122357-96-4

    References

    • Leighty, Matthew W.; Spletstoser, Jared T.; Georg, Gunda I. Organic Syntheses, 2012 , vol. 88, p. 427 - 437
  • Route3

    References

    • Zhao, Yigang; Snieckus, Victor Organic Letters, 2014 , vol. 16, # 2 p. 390 - 393

Safety Information

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Computational Chemistry Data

  • TPSA   46.61
  • LogP   1.9552
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   4

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