6-Nitro-N-Nonyl-4H-1,3,2-Benzodioxaphosphorin-2-Amine 2-Sulfide
[CAS# 99313-47-0]

Identification

• Name: 6-Nitro-N-Nonyl-4H-1,3,2-Benzodioxaphosphorin-2-Amine 2-Sulfide
• Synonyms: 3-Nitro-N-Nonyl-8-Thioxo-7,9-Dioxa-8$L^{5}-Phosphabicyclo[4.4.0]Deca-1(6),2,4-Trien-8-Amine; (3-Nitro-8-Thioxo-7,9-Dioxa-8$L^{5}-Phosphabicyclo[4.4.0]Deca-1(6),2,4-Trien-8-Yl)-Nonyl-Amine; 4H-1,3,2-Benzodioxaphosphosporin-2-Amine, 6-Nitro-N-Nonyl-, 2-Sulfid
• Molecular Formula: C₁₆H₂₅N₂O₄PS
• Molecular Weight: 372.42
• CAS Registry Number: 99313-47-0
• SMILES: C1=C2C(=CC=C1[N+]([O-])=O)O[P](=S)(OC2)NCCCCCCCCC
• InChI: 1S/C16H25N2O4PS/c1-2-3-4-5-6-7-8-11-17-23(24)21-13-14-12-15(18(19)20)9-10-16(14)22-23/h9-10,12H,2-8,11,13H2,1H3,(H,17,24)
• InChIKey: NUWUCZXYNLZSGN-UHFFFAOYSA-N

Properties

• Density: 1.241g/cm³ (Cal.)
• Boiling point: 472.019°C at 760 mmHg (Cal.)
• Flash point: 239.269°C (Cal.)