Hexyl vanillate-2-ethoxybenzoic acid
[CAS# 126294-32-4]

Identification

• Name: Hexyl vanillate-2-ethoxybenzoic acid
• Synonyms: 2-Ethoxybenzoic Acid; Hexyl 3-Hydroxy-4-Methoxy-Benzoate; 2-Ethoxybenzoic Acid; 3-Hydroxy-4-Methoxybenzoic Acid Hexyl Ester; 2-Ethoxybenzoic Acid; 3-Hydroxy-4-Methoxy-Benzoic Acid Hexyl Ester
• Molecular Formula: C₂₃H₃₀O₇
• Molecular Weight: 418.49
• CAS Registry Number: 126294-32-4
• SMILES: C1=C(O)C(=CC=C1C(OCCCCCC)=O)OC.C2=C(C(=CC=C2)OCC)C(=O)O
• InChI: 1S/C14H20O4.C9H10O3/c1-3-4-5-6-9-18-14(16)11-7-8-13(17-2)12(15)10-11;1-2-12-8-6-4-3-5-7(8)9(10)11/h7-8,10,15H,3-6,9H2,1-2H3;3-6H,2H2,1H3,(H,10,11)
• InChIKey: KZDWDKBYOYJQHZ-UHFFFAOYSA-N

Properties

• Boiling point: 389.7°C at 760 mmHg (Cal.)
• Flash point: 141.4°C (Cal.)