12-(Anthracene-9-Carbonyl)Octadecanoic Acid
[CAS# 37469-99-1]

Identification

• Name: 12-(Anthracene-9-Carbonyl)Octadecanoic Acid
• Synonyms: 12-(9-Anthryl-Oxomethyl)Octadecanoic Acid; 12-(Anthracene-9-Carbonyl)Stearic Acid; 12-Anthracen-9-Ylcarbonyloctadecanoic Acid
• Molecular Formula: C₃₃H₄₄O₃
• Molecular Weight: 488.71
• CAS Registry Number: 37469-99-1
• SMILES: C1=CC=C2C(=C1)C=C3C(=C2C(=O)C(CCCCCC)CCCCCCCCCCC(O)=O)C=CC=C3
• InChI: 1S/C33H44O3/c1-2-3-4-11-18-26(19-12-9-7-5-6-8-10-13-24-31(34)35)33(36)32-29-22-16-14-20-27(29)25-28-21-15-17-23-30(28)32/h14-17,20-23,25-26H,2-13,18-19,24H2,1H3,(H,34,35)
• InChIKey: JMMLWELOFXAQEI-UHFFFAOYSA-N

Properties

• Density: 1.051g/cm³ (Cal.)
• Boiling point: 657.95°C at 760 mmHg (Cal.)
• Flash point: 365.705°C (Cal.)