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CS-W001157 4
Total: USD 88.00

3-(Dimethylamino)benzoic acid methyl ester

  • CAS No. 16518-64-2

  • Cat. No. CS-0213405
  • Purity≥98%
  • MDL No.MFCD00144731

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

3-(Dimethylamino)benzoic acid methyl ester|CS-0213405

Structure of 16518-64-2

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General Information

  • CAS No. 16518-64-2
  • Cat. No. CS-0213405
  • Purity ≥98%
  • MDL No. MFCD00144731
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₃NO₂
  • Molecular Weight 179.22
  • Synonym(s) METHYL 3-DIMETHYLAMINOBENZOATE
  • SMILES CN(C)C1=CC=CC(=C1)C(=O)OC

Synthesis

  • Route1
    • In-stock
      3-Dimethylaminobenzyl alcohol|CS-0204383
      23501-93-1
    • null|null
      865-33-8
    • ~89%
    • In-stock
      3-(Dimethylamino)benzoic acid methyl ester|CS-0213405
      16518-64-2

    References

    • Powell, Adam B.; Stahl, Shannon S. Organic Letters, 2013 , vol. 15, # 19 p. 5072 - 5075
  • Route2
    • null|null
      34472-65-6
    • In-stock
      3-(Dimethylamino)benzoic acid|CS-W018494
      99-64-9
    • ~92%
    • In-stock
      3-(Dimethylamino)benzoic acid methyl ester|CS-0213405
      16518-64-2

    References

    • SMITHKLINE BEECHAM CORPORATION Patent: WO2009/32667 A1, 2009 ; Location in patent: Page/Page column 163 ; WO 2009/032667 A1
  • Route3
    • null|null
      67-56-1
    • In-stock
      3-(Dimethylamino)benzoic acid|CS-W018494
      99-64-9
    • ~99%
    • In-stock
      3-(Dimethylamino)benzoic acid methyl ester|CS-0213405
      16518-64-2

    References

    • Wang, Pengfei; Zhou, Lei; Zhang, Xin; Liang, Xing Chemical Communications, 2010 , vol. 46, # 9 p. 1514 - 1516

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   29.54
  • LogP   1.5392
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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