5-[2-(2-Carboxyethyl)-3-[(E)-6-(4-Methoxyphenyl)Hex-5-Enoxy]Phenoxy]Pentanoic Acid
[CAS# 134578-96-4]

Identification

• Name: 5-[2-(2-Carboxyethyl)-3-[(E)-6-(4-Methoxyphenyl)Hex-5-Enoxy]Phenoxy]Pentanoic Acid
• Synonyms: 5-[2-(2-Carboxyethyl)-3-[(E)-6-(4-Methoxyphenyl)Hex-5-Enoxy]Phenoxy]Valeric Acid; 5-(2-(2-Carboxyethyl)-3-(6-(4-Methoxyphenyl)-5E-Hexenyl)Oxyphenoxy)Valeric Acid; Benzenepropanoic Acid, 2-(4-Carboxybutoxy)-6-((6-(4-Methoxyphenyl)-5-Hexenyl)Oxy)-, (E)-
• Molecular Formula: C₂₇H₃₄O₇
• Molecular Weight: 470.56
• CAS Registry Number: 134578-96-4
• SMILES: C2=C(OCCCC/C=C/C1=CC=C(OC)C=C1)C(=C(OCCCCC(=O)O)C=C2)CCC(=O)O
• InChI: 1S/C27H34O7/c1-32-22-15-13-21(14-16-22)9-4-2-3-6-19-33-24-10-8-11-25(23(24)17-18-27(30)31)34-20-7-5-12-26(28)29/h4,8-11,13-16H,2-3,5-7,12,17-20H2,1H3,(H,28,29)(H,30,31)/b9-4+
• InChIKey: JOPSSWGWLCLPPF-RUDMXATFSA-N

Properties

• Density: 1.174g/cm³ (Cal.)
• Boiling point: 704.823°C at 760 mmHg (Cal.)
• Flash point: 233.084°C (Cal.)