N,N-Dihexadecyl-4-Nitro-2,1,3-Benzoxadiazol-7-Amine
[CAS# 117056-66-3]

Identification

• Name: N,N-Dihexadecyl-4-Nitro-2,1,3-Benzoxadiazol-7-Amine
• Synonyms: Dicetyl-(7-Nitrobenzofurazan-4-Yl)Amine; 2,1,3-Benzoxadiazol-4-Amine, N,N-Dihexadecyl-7-Nitro-; 4-(N,N-Dihexadecyl)Amino-7-Nitrobenz-2-Oxa-1,3-Diazole
• Molecular Formula: C₃₈H₆₈N₄O₃
• Molecular Weight: 628.98
• CAS Registry Number: 117056-66-3
• SMILES: C2=C(C1=NON=C1C(=C2)[N+](=O)[O-])N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC
• InChI: 1S/C38H68N4O3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-33-41(35-31-32-36(42(43)44)38-37(35)39-45-40-38)34-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h31-32H,3-30,33-34H2,1-2H3
• InChIKey: JVTZCQBNIYPZGI-UHFFFAOYSA-N

Properties

• Density: 0.986g/cm³ (Cal.)
• Boiling point: 695.212°C at 760 mmHg (Cal.)
• Flash point: 374.251°C (Cal.)