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366226

Sigma-Aldrich

Diethyl (phthalimidomethyl)phosphonate

97%

Empirical Formula (Hill Notation):
C13H16NO5P
CAS Number:
Molecular Weight:
297.24
MDL number:
PubChem Substance ID:
NACRES:
NA.22

Quality Level

assay

97%

form

solid

reaction suitability

reaction type: C-C Bond Formation

mp

60-64 °C (lit.)

SMILES string

CCOP(=O)(CN1C(=O)c2ccccc2C1=O)OCC

InChI

1S/C13H16NO5P/c1-3-18-20(17,19-4-2)9-14-12(15)10-7-5-6-8-11(10)13(14)16/h5-8H,3-4,9H2,1-2H3

InChI key

IUZMHUAHKBHJFY-UHFFFAOYSA-N

Application

Reacant for:
  • Horner-Wadsworth-Emmons reactions
  • Preparation of macrocyclic phosphorous acid analogs as inhibitors of HCV-NS3 protease
  • Synthesis of dendrimer-based pH-responsive MRI contrast agent
Wittig carbonylating reagent.

Packaging

25 g in poly bottle

Pictograms

Skull and crossbones

Signal Word

Danger

Hazard Statements

Precautionary Statements

Hazard Classifications

Acute Tox. 3 Oral

Storage Class Code

6.1D - Non-combustible, acute toxic Cat.3 / toxic hazardous materials or hazardous materials causing chronic effects

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Certificate of Analysis

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Certificate of Origin

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