3-(4-Carboxy-2-Methoxyphenoxy)-4-Hydroxy-5-Methoxybenzoic Acid
[CAS# 2555-99-9]

Identification

• Name: 3-(4-Carboxy-2-Methoxyphenoxy)-4-Hydroxy-5-Methoxybenzoic Acid
• Synonyms: 3-(4-Carboxy-2-Methoxy-Phenoxy)-4-Hydroxy-5-Methoxy-Benzoic Acid; Vanillic Acid, 5-(4-Carboxy-2-Methoxyphenoxy)-
• Molecular Formula: C₁₆H₁₄O₈
• Molecular Weight: 334.28
• CAS Registry Number: 2555-99-9
• SMILES: C1=C(C(=C(C=C1C(=O)O)OC)O)OC2=CC=C(C=C2OC)C(=O)O
• InChI: 1S/C16H14O8/c1-22-11-5-8(15(18)19)3-4-10(11)24-13-7-9(16(20)21)6-12(23-2)14(13)17/h3-7,17H,1-2H3,(H,18,19)(H,20,21)
• InChIKey: LFDSABYJTKMLLF-UHFFFAOYSA-N

Properties

• Density: 1.444g/cm³ (Cal.)
• Boiling point: 538.249°C at 760 mmHg (Cal.)
• Flash point: 199.191°C (Cal.)