3-[(3-Formyl-2-Hydroxy-4-Methoxy-6-Methylbenzoyl)Oxy]-6-Hydroxy-2,5-Dimethylbenzoic Acid
[CAS# 644-66-6]

Identification

• Name: 3-[(3-Formyl-2-Hydroxy-4-Methoxy-6-Methylbenzoyl)Oxy]-6-Hydroxy-2,5-Dimethylbenzoic Acid
• Synonyms: BAEOMYCESIC ACID; KBio3_002113; KBioGR_002546
• Molecular Formula: C₁₉H₁₈O₈
• Molecular Weight: 374.34
• CAS Registry Number: 644-66-6
• SMILES: CC1=CC(=C(C(=C1C(=O)OC2=C(C(=C(C(=C2)C)O)C(=O)O)C)O)C=O)OC
• InChI: 1S/C19H18O8/c1-8-5-13(26-4)11(7-20)17(22)14(8)19(25)27-12-6-9(2)16(21)15(10(12)3)18(23)24/h5-7,21-22H,1-4H3,(H,23,24)
• InChIKey: IGTAVCGEZLIHKG-UHFFFAOYSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 599.6±50.0°C at 760 mmHg (Cal.)
• Flash point: 214.9±23.6°C (Cal.)