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CS-W001157 4
Total: USD 88.00

Methyl 4-(1-aminoethyl)benzoate

  • CAS No. 80051-07-6

  • Cat. No. CS-M0171
  • Purity≥97%
  • MDL No.MFCD11505984

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

Methyl 4-(1-aminoethyl)benzoate|CS-M0171

Structure of 80051-07-6

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General Information

  • CAS No. 80051-07-6
  • Cat. No. CS-M0171
  • Purity ≥97%
  • MDL No. MFCD11505984
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₃NO₂
  • Molecular Weight 179.22
  • Synonym(s) Benzoic acid, 4-(1-aminoethyl)-, methyl ester
  • SMILES O=C(OC)C1=CC=C(C(C)N)C=C1

Synthesis

  • Route1
    • In-stock
      Methyl 4-acetylbenzoate|CS-M0170
      3609-53-8
    • null|null
      593-51-1
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      74-89-5
    • ~73%
    • In-stock
      Methyl 4-(1-aminoethyl)benzoate|CS-M0171
      80051-07-6

    References

    • EVOTEC NEUROSCIENCES GMBH; MADDEN, James; HALLETT, David James; PARKES, Alastair; RAOOF, Ali; WANG, Xialou Patent: WO2010/20556 A1, 2010 ; Location in patent: Page/Page column 169-170 ; WO 2010/020556 A1

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   52.32
  • LogP   1.4929
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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