Ethyl (4-Benzothiazol-2-Ylbenzyl)(2-Oxopyrrolidino)Phosphinate
[CAS# 104608-36-8]

Identification

• Name: Ethyl (4-Benzothiazol-2-Ylbenzyl)(2-Oxopyrrolidino)Phosphinate
• Synonyms: 1-[[4-(1,3-Benzothiazol-2-Yl)Phenyl]Methyl-Ethoxy-Phosphoryl]Pyrrolidin-2-One; 1-[[4-(1,3-Benzothiazol-2-Yl)Phenyl]Methyl-Ethoxyphosphoryl]-2-Pyrrolidinone; 1-[[4-(1,3-Benzothiazol-2-Yl)Benzyl]-Ethoxy-Phosphoryl]-2-Pyrrolidone
• Molecular Formula: C₂₀H₂₁N₂O₃PS
• Molecular Weight: 400.43
• CAS Registry Number: 104608-36-8
• SMILES: C1=CC=CC2=C1SC(=N2)C3=CC=C(C=C3)C[P](=O)(OCC)N4C(=O)CCC4
• InChI: 1S/C20H21N2O3PS/c1-2-25-26(24,22-13-5-8-19(22)23)14-15-9-11-16(12-10-15)20-21-17-6-3-4-7-18(17)27-20/h3-4,6-7,9-12H,2,5,8,13-14H2,1H3
• InChIKey: HTAUUADKDLLMRU-UHFFFAOYSA-N

Properties

• Density: 1.349g/cm³ (Cal.)
• Boiling point: 559.428°C at 760 mmHg (Cal.)
• Flash point: 292.132°C (Cal.)