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Methyl 3-(4-(aminomethyl)phenyl)propanoate

  • CAS No. 100511-78-2

  • Cat. No. CS-0034234
  • Molecule weight193.24
  • Purity98+%
  • MDL No.MFCD08060494

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

Methyl 3-(4-(aminomethyl)phenyl)propanoate|CS-0034234

Structure of 100511-78-2

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General Information

  • CAS No. 100511-78-2
  • Cat. No. CS-0034234
  • Purity 98+%
  • MDL No. MFCD08060494
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₅NO₂
  • Molecular Weight 193.24
  • Synonym(s) NSC 46327; Methyl 3-[4-(aminomethyl)phenyl]propionate
  • SMILES O=C(OC)CCC1=CC=C(CN)C=C1

Synthesis

  • Route1

    References

    • Zaidan Hojin Biseibutsu Kagaku Kenkyukai Patent: US4556735 A1, 1985 ;
  • Route2
    • null|null
      132691-44-2
    • ~%
    • Methyl 3-(4-(aminomethyl)phenyl)propanoate|CS-0034234
      100511-78-2

    References

    • MedChemComm, , vol. 4, # 12 p. 1562 - 1570
  • Route3

    References

    • MedChemComm, , vol. 4, # 12 p. 1562 - 1570

Safety Information

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Computational Chemistry Data

  • TPSA   52.32
  • LogP   1.2509
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   4

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