N-Cyclohexyl-6-Nitro-4H-1,3,2-Benzodioxaphosphorin-2-Amine 2-Sulfide
[CAS# 99300-59-1]

Identification

• Name: N-Cyclohexyl-6-Nitro-4H-1,3,2-Benzodioxaphosphorin-2-Amine 2-Sulfide
• Synonyms: N-Cyclohexyl-3-Nitro-8-Thioxo-7,9-Dioxa-8$L^{5}-Phosphabicyclo[4.4.0]Deca-1(6),2,4-Trien-8-Amine; Cyclohexyl-(3-Nitro-8-Thioxo-7,9-Dioxa-8$L^{5}-Phosphabicyclo[4.4.0]Deca-1(6),2,4-Trien-8-Yl)Amine; 4H-1,3,2-Benzodioxaphosphorin-2-Amine, N-Cyclohexyl-6-Nitro
• Molecular Formula: C₁₃H₁₇N₂O₄PS
• Molecular Weight: 328.32
• CAS Registry Number: 99300-59-1
• SMILES: C1=C2C(=CC=C1[N+]([O-])=O)O[P](=S)(OC2)NC3CCCCC3
• InChI: 1S/C13H17N2O4PS/c16-15(17)12-6-7-13-10(8-12)9-18-20(21,19-13)14-11-4-2-1-3-5-11/h6-8,11H,1-5,9H2,(H,14,21)
• InChIKey: RAIITXUYMWRBQD-UHFFFAOYSA-N

Properties

• Density: 1.408g/cm³ (Cal.)
• Boiling point: 453.264°C at 760 mmHg (Cal.)
• Flash point: 227.926°C (Cal.)