Phosphorothioic Acid O,O-Dimethyl O-(3-Isopropyl-4-Nitrophenyl) Ester
[CAS# 1592-82-1]

Identification

• Name: Phosphorothioic Acid O,O-Dimethyl O-(3-Isopropyl-4-Nitrophenyl) Ester
• Synonyms: (3-Isopropyl-4-Nitro-Phenoxy)-Dimethoxy-Thioxo-Phosphorane; (3-Isopropyl-4-Nitrophenoxy)-Dimethoxy-Thioxophosphorane; Dimethoxy-(4-Nitro-3-Propan-2-Yl-Phenoxy)-Sulfanylidene-Phosphorane
• Molecular Formula: C₁₁H₁₆NO₅PS
• Molecular Weight: 305.28
• CAS Registry Number: 1592-82-1
• SMILES: C1=C(C(C)C)C(=CC=C1O[P](=S)(OC)OC)[N+]([O-])=O
• InChI: 1S/C11H16NO5PS/c1-8(2)10-7-9(5-6-11(10)12(13)14)17-18(19,15-3)16-4/h5-8H,1-4H3
• InChIKey: MPCILJQVDVSLSZ-UHFFFAOYSA-N

Properties

• Density: 1.29g/cm³ (Cal.)
• Boiling point: 382.138°C at 760 mmHg (Cal.)
• Flash point: 184.911°C (Cal.)