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CS-W001157 4
Total: USD 88.00

Ethyl 2-(4-nitrophenyl)propanoate

  • CAS No. 50712-64-6

  • Cat. No. CS-0312121
  • Molecule weight223.23
  • Purity≥98%
  • MDL No.MFCD12031819

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

Ethyl 2-(4-nitrophenyl)propanoate|CS-0312121

Structure of 50712-64-6

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General Information

  • CAS No. 50712-64-6
  • Cat. No. CS-0312121
  • Purity ≥98%
  • MDL No. MFCD12031819
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₃NO₄
  • Molecular Weight 223.23
  • Synonym(s) Ethyl 2-(4-nitrophenyl)propionate
  • SMILES CC(C1=CC=C([N+]([O-])=O)C=C1)C(OCC)=O

Synthesis

  • Route1
    • Ethyl 2-(4-nitrophenyl)acetate|CS-W005171
      5445-26-1
    • null|null
      74-88-4
    • ~90%
    • Ethyl 2-(4-nitrophenyl)propanoate|CS-0312121
      50712-64-6

    References

    • Gruenenthal GmbH Patent: US2009/156590 A1, 2009 ; Location in patent: Page/Page column 59 ; US 20090156590 A1
  • Route2

    References

    • Gruenenthal GmbH Patent: US2009/156590 A1, 2009 ; Location in patent: Page/Page column 62; 64; 65-66 ; US 20090156590 A1
  • Route3

    References

    • Merck and Co., Inc. Patent: US5981550 A1, 1999 ; US 5981550 A

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   69.44
  • LogP   2.2614
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   4

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