2-Hydroxy-4-[(2-hydroxy-4-methoxy-6-pentylbenzoyl)oxy]-6-pentylbenzoic acid
[CAS# 529-47-5]

Identification

• Name: 2-Hydroxy-4-[(2-hydroxy-4-methoxy-6-pentylbenzoyl)oxy]-6-pentylbenzoic acid
• Synonyms: 2-Hydroxy-4-(2-Hydroxy-4-Methoxy-6-Pentyl-Benzoyl)Oxy-6-Pentyl-Benzoic Acid; 2-Hydroxy-4-[(2-Hydroxy-4-Methoxy-6-Pentylphenyl)-Oxomethoxy]-6-Pentylbenzoic Acid; 2-Amyl-4-(2-Amyl-6-Hydroxy-4-Methoxy-Benzoyl)Oxy-6-Hydroxy-Benzoic Acid
• Molecular Formula: C₂₅H₃₂O₇
• Molecular Weight: 444.52
• CAS Registry Number: 529-47-5
• SMILES: C1=C(C(=C(C=C1OC(C2=C(C=C(C=C2O)OC)CCCCC)=O)CCCCC)C(=O)O)O
• InChI: 1S/C25H32O7/c1-4-6-8-10-16-13-19(15-20(26)22(16)24(28)29)32-25(30)23-17(11-9-7-5-2)12-18(31-3)14-21(23)27/h12-15,26-27H,4-11H2,1-3H3,(H,28,29)
• InChIKey: UTAQXQVSEKIWBB-UHFFFAOYSA-N

Properties

• Density: 1.198g/cm³ (Cal.)
• Boiling point: 612.983°C at 760 mmHg (Cal.)
• Flash point: 202.74°C (Cal.)