Ethylphosphonothioic Acid O-Ethyl O-(3-Methyl-4-Nitrophenyl) Ester
[CAS# 18313-91-2]

Identification

• Name: Ethylphosphonothioic Acid O-Ethyl O-(3-Methyl-4-Nitrophenyl) Ester
• Synonyms: Ethoxy-Ethyl-(2-Methyl-3-Nitro-Phenoxy)-Thioxo-Phosphorane; Ethoxy-Ethyl-(2-Methyl-3-Nitrophenoxy)-Thioxophosphorane; Ethoxy-Ethyl-(2-Methyl-3-Nitro-Phenoxy)-Sulfanylidene-Phosphorane
• Molecular Formula: C₁₁H₁₆NO₄PS
• Molecular Weight: 289.29
• CAS Registry Number: 18313-91-2
• SMILES: C1=CC=C(C(=C1[N+]([O-])=O)C)O[P](=S)(OCC)CC
• InChI: 1S/C11H16NO4PS/c1-4-15-17(18,5-2)16-11-8-6-7-10(9(11)3)12(13)14/h6-8H,4-5H2,1-3H3
• InChIKey: QUJSLFBJDWGGJL-UHFFFAOYSA-N

Properties

• Density: 1.261g/cm³ (Cal.)
• Boiling point: 360.519°C at 760 mmHg (Cal.)
• Flash point: 171.836°C (Cal.)