N,N-Diethyl-6-Nitro-4H-1,3,2-Benzodioxaphosphorin-2-Amine 2-Sulfide
[CAS# 99300-57-9]

Identification

• Name: N,N-Diethyl-6-Nitro-4H-1,3,2-Benzodioxaphosphorin-2-Amine 2-Sulfide
• Synonyms: N,N-Diethyl-3-Nitro-8-Thioxo-7,9-Dioxa-8$L^{5}-Phosphabicyclo[4.4.0]Deca-1(6),2,4-Trien-8-Amine; Diethyl-(3-Nitro-8-Thioxo-7,9-Dioxa-8$L^{5}-Phosphabicyclo[4.4.0]Deca-1(6),2,4-Trien-8-Yl)Amine; 4H-1,3,2-Benzodioxaphosphorin-2-Amine, N,N-Diethyl-6-Nitro-, 2-
• Molecular Formula: C₁₁H₁₅N₂O₄PS
• Molecular Weight: 302.28
• CAS Registry Number: 99300-57-9
• SMILES: C1=C2C(=CC=C1[N+]([O-])=O)O[P](=S)(OC2)N(CC)CC
• InChI: 1S/C11H15N2O4PS/c1-3-12(4-2)18(19)16-8-9-7-10(13(14)15)5-6-11(9)17-18/h5-7H,3-4,8H2,1-2H3
• InChIKey: RFKJUUCIILYXBE-UHFFFAOYSA-N

Properties

• Density: 1.389g/cm³ (Cal.)
• Boiling point: 401.676°C at 760 mmHg (Cal.)
• Flash point: 196.727°C (Cal.)