Phenylphosphonothioic Acid O-(2-Nitrophenyl)O-Ethyl Ester
[CAS# 57856-21-0]

Identification

• Name: Phenylphosphonothioic Acid O-(2-Nitrophenyl)O-Ethyl Ester
• Synonyms: Ethoxy-(2-Nitrophenoxy)-Phenyl-Thioxo-Phosphorane; Ethoxy-(2-Nitrophenoxy)-Phenyl-Thioxophosphorane; Ethoxy-(2-Nitrophenoxy)-Phenyl-Sulfanylidene-Phosphorane
• Molecular Formula: C₁₄H₁₄NO₄PS
• Molecular Weight: 323.30
• CAS Registry Number: 57856-21-0
• SMILES: C2=C([P](OC1=C(C=CC=C1)[N+]([O-])=O)(OCC)=S)C=CC=C2
• InChI: 1S/C14H14NO4PS/c1-2-18-20(21,12-8-4-3-5-9-12)19-14-11-7-6-10-13(14)15(16)17/h3-11H,2H2,1H3
• InChIKey: QFIIQNTUZPMZGP-UHFFFAOYSA-N

Properties

• Density: 1.341g/cm³ (Cal.)
• Boiling point: 428.703°C at 760 mmHg (Cal.)
• Flash point: 213.072°C (Cal.)