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CS-W001157 4
Total: USD 88.00

Methyl (4-nitrophenyl) carbonate

  • CAS No. 17175-16-5

  • Cat. No. CS-0569432
  • Molecule weight197.14
  • Purity≥98%
  • MDL No.None

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

Methyl (4-nitrophenyl) carbonate|CS-0569432

Structure of 17175-16-5

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General Information

  • CAS No. 17175-16-5
  • Cat. No. CS-0569432
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇NO₅
  • Molecular Weight 197.14
  • Synonym(s) Methyl p-nitrophenyl carbonate
  • SMILES COC(=O)OC1=CC=C(C=C1)[N+](=O)[O-]

Description

Methyl (4-nitrophenyl) carbonate is a bench-stable, moisture-tolerant reagent featuring a para-nitro group that enhances electrophilicity at the carbonyl center. This compound facilitates efficient O-alkylation of phenols and alcohols under mild conditions, delivering protected derivatives with high selectivity. Its stability simplifies handling in synthetic workflows.

Application

Methyl (4-nitrophenyl) carbonate serves as a stable, bench-ready carbonylating agent for the synthesis of esters and carbamates. Its mild reactivity enables efficient O- and N-alkylation under ambient conditions, with the 4-nitrophenyl leaving group facilitating clean displacement. The compound exhibits excellent functional group tolerance and is readily purified by flash chromatography, making it well-suited for iterative synthetic workflows in medicinal chemistry and process development.

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

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Computational Chemistry Data

  • TPSA   78.67
  • LogP   1.74
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   2

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