2,3,4,5-Tetrachloro-6-(1-Phenylpentoxycarbonyl)Benzoic Acid
[CAS# 73972-99-3]

Identification

• Name: 2,3,4,5-Tetrachloro-6-(1-Phenylpentoxycarbonyl)Benzoic Acid
• Synonyms: 2,3,4,5-Tetrachloro-6-[Oxo-(1-Phenylpentoxy)Methyl]Benzoic Acid; 1-Phenyl-1-Amyl Hydrogen Tetrachlorophthalate; Phthalic Acid, Tetrachloro-, Mono(1-Phenylpentyl) Ester
• Molecular Formula: C₁₉H₁₆Cl₄O₄
• Molecular Weight: 450.15
• CAS Registry Number: 73972-99-3
• SMILES: C1=CC=CC=C1C(OC(C2=C(C(=C(C(=C2C(=O)O)Cl)Cl)Cl)Cl)=O)CCCC
• InChI: 1S/C19H16Cl4O4/c1-2-3-9-11(10-7-5-4-6-8-10)27-19(26)13-12(18(24)25)14(20)16(22)17(23)15(13)21/h4-8,11H,2-3,9H2,1H3,(H,24,25)
• InChIKey: ITJBIZVACKITLW-UHFFFAOYSA-N

Properties

• Density: 1.428g/cm³ (Cal.)
• Boiling point: 554.147°C at 760 mmHg (Cal.)
• Flash point: 288.938°C (Cal.)