1-Propynylphosphonic Acid Di(2-Propynyl) Ester
[CAS# 63869-29-4]

Identification

• Name: 1-Propynylphosphonic Acid Di(2-Propynyl) Ester
• Synonyms: 1-[Ethoxy-(4-Nitrophenoxy)Phosphoryl]-4-Propyl-Benzene
• Molecular Formula: C₁₇H₂₀NO₅P
• Molecular Weight: 349.32
• CAS Registry Number: 63869-29-4
• SMILES: C2=C([P](OC1=CC=C([N+]([O-])=O)C=C1)(OCC)=O)C=CC(=C2)CCC
• InChI: 1S/C17H20NO5P/c1-3-5-14-6-12-17(13-7-14)24(21,22-4-2)23-16-10-8-15(9-11-16)18(19)20/h6-13H,3-5H2,1-2H3
• InChIKey: HIHSLAUNYIKQDA-UHFFFAOYSA-N

Properties

• Density: 1.242g/cm³ (Cal.)
• Boiling point: 466.953°C at 760 mmHg (Cal.)
• Flash point: 236.205°C (Cal.)