Pentachlorophenyl Palmitate
[CAS# 97457-27-7]

Identification

• Name: Pentachlorophenyl Palmitate
• Synonyms: Hexadecanoic Acid (2,3,4,5,6-Pentachlorophenyl) Ester; Palmitic Acid (2,3,4,5,6-Pentachlorophenyl) Ester; Palmitoylpentachlorophenol
• Molecular Formula: C₂₂H₃₁Cl₅O₂
• Molecular Weight: 504.75
• CAS Registry Number: 97457-27-7
• SMILES: C(CCCCCCCCCCCCCC)C(OC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)=O
• InChI: 1S/C22H31Cl5O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(28)29-22-20(26)18(24)17(23)19(25)21(22)27/h2-15H2,1H3
• InChIKey: BSEOMYSJGWQRAT-UHFFFAOYSA-N

Properties

• Density: 1.208g/cm³ (Cal.)
• Boiling point: 540.722°C at 760 mmHg (Cal.)
• Flash point: 161.006°C (Cal.)