O-Ethyl S-2-diisopropylaminoethyl methylphosphonothiolate
[CAS# 50782-69-9]

Identification

• Name: O-Ethyl S-2-diisopropylaminoethyl methylphosphonothiolate
• Synonyms: N-[2-(Ethoxy-Methyl-Phosphoryl)Sulfanylethyl]-N-Isopropyl-Propan-2-Amine; N-[2-[(Ethoxy-Methylphosphoryl)Thio]Ethyl]-N-Isopropylpropan-2-Amine; 2-[(Ethoxy-Methyl-Phosphoryl)Thio]Ethyl-Diisopropyl-Amine
• Molecular Formula: C₁₁H₂₆NO₂PS
• Molecular Weight: 267.37
• CAS Registry Number: 50782-69-9
• SMILES: C(N(C(C)C)C(C)C)CS[P](OCC)(C)=O
• InChI: 1S/C11H26NO2PS/c1-7-14-15(6,13)16-9-8-12(10(2)3)11(4)5/h10-11H,7-9H2,1-6H3
• InChIKey: JJIUCEJQJXNMHV-UHFFFAOYSA-N

Properties

• Density: 1.0±0.1g/cm³ (Cal.)
• Boiling point: 318.8±44.0°C at 760 mmHg (Cal.)
• Flash point: 146.6±28.4°C (Cal.)

References

• (1): Ştefan Neaţu, Bogdan Cojocaru, Vasile I. Pârvulescu, Vasile Şomoghi, Mercedes Alvaro and Hermenegildo Garcia. Visible-light C–heteroatom bond cleavage and detoxification of chemical warfare agents using titania-supported gold nanoparticles as photocatalyst, J. Mater. Chem., 2010, 20, 4050.