6-Nitro-N-pentadecyl-4H-1,3,2-benzodioxaphosphorin-2-amine 2-sulfide
[CAS# 130365-35-4]

Identification

• Name: 6-Nitro-N-pentadecyl-4H-1,3,2-benzodioxaphosphorin-2-amine 2-sulfide
• Synonyms: 3-Nitro-N-Pentadecyl-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)-Pentadecyl-Amine; 4H-1,3,2-Benzodioxaphosphorin-2-Amine, 6-Nitro-N-Pentadecyl-, 2-Sulfide
• Molecular Formula: C₂₂H₃₇N₂O₄PS
• Molecular Weight: 456.58
• CAS Registry Number: 130365-35-4
• SMILES: C1=C2C(=CC=C1[N+]([O-])=O)O[P](=S)(OC2)NCCCCCCCCCCCCCCC
• InChI: 1S/C22H37N2O4PS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-23-29(30)27-19-20-18-21(24(25)26)15-16-22(20)28-29/h15-16,18H,2-14,17,19H2,1H3,(H,23,30)
• InChIKey: FGYRTSTYZUABEV-UHFFFAOYSA-N

Properties

• Density: 1.15g/cm³ (Cal.)
• Boiling point: 541.805°C at 760 mmHg (Cal.)
• Flash point: 281.474°C (Cal.)