Carbonothioic Acid O-(2-Sec-Butyl-4,6-Dinitrophenyl)S-Butyl Ester
[CAS# 14355-07-8]

Identification

• Name: Carbonothioic Acid O-(2-Sec-Butyl-4,6-Dinitrophenyl)S-Butyl Ester
• Synonyms: (2,4-Dinitro-6-Sec-Butyl-Phenyl) Butylsulfanylformate; (Butylthio)Formic Acid (2,4-Dinitro-6-Sec-Butylphenyl) Ester; (Butylthio)Formic Acid (2,4-Dinitro-6-Sec-Butyl-Phenyl) Ester
• Molecular Formula: C₁₅H₂₀N₂O₆S
• Molecular Weight: 356.39
• CAS Registry Number: 14355-07-8
• SMILES: C1=C(C=C(C(=C1C(CC)C)OC(SCCCC)=O)[N+](=O)[O-])[N+](=O)[O-]
• InChI: 1S/C15H20N2O6S/c1-4-6-7-24-15(18)23-14-12(10(3)5-2)8-11(16(19)20)9-13(14)17(21)22/h8-10H,4-7H2,1-3H3
• InChIKey: CZWKWVSHPUKOAT-UHFFFAOYSA-N

Properties

• Density: 1.269g/cm³ (Cal.)
• Boiling point: 457.195°C at 760 mmHg (Cal.)
• Flash point: 230.304°C (Cal.)