Diethyl (Phthalimidomethyl)phosphonate , >98.0% , 33512-26-4

CAS NO.：33512-26-4

Empirical Formula: C13H16NO5P

Molecular Weight: 297.24

MDL number: MFCD00134313

PRODUCT Properties

• Melting point: 60-64 °C(lit.)
• Boiling point: 423.3±28.0 °C(Predicted)
• Density: 1.312±0.06 g/cm3(Predicted)
• storage temp.: Storage temp. 2-8°C
• pka: -2.49±0.20(Predicted)
• form: solid
• color: White to Almost white
• InChI: 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
• InChIKey: IUZMHUAHKBHJFY-UHFFFAOYSA-N
• SMILES: P(CN1C(=O)C2=C(C1=O)C=CC=C2)(=O)(OCC)OCC
• CAS DataBase Reference: 33512-26-4(CAS DataBase Reference)

Description and Uses

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

Safety

• Symbol(GHS): GHS06
• Signal word: Danger
• Hazard statements: H301
• Precautionary statements: P301+P310
• Hazard Codes: T
• Risk Statements: 25
• Safety Statements: 45-24/25
• RIDADR: UN 2811 6.1 / PGIII
• WGK Germany: 3
• HS Code: 29337900