4-(6-Methoxy-1-Oxo-1,2,3,4-Tetrahydro-2-Naphthalenyl)-4-Oxobutanoic Acid
[CAS# 100976-74-7]

Identification

• Name: 4-(6-Methoxy-1-Oxo-1,2,3,4-Tetrahydro-2-Naphthalenyl)-4-Oxobutanoic Acid
• Synonyms: 3-(1,2,3,4-Tetrahydro-6-methoxy-1-oxo-2-naphthoyl)propionicacid
• Molecular Formula: C₁₅H₁₆O₅
• Molecular Weight: 276.28
• CAS Registry Number: 100976-74-7
• SMILES: COc1ccc2c(c1)CCC(C2=O)C(=O)CCC(=O)O
• InChI: 1S/C15H16O5/c1-20-10-3-5-11-9(8-10)2-4-12(15(11)19)13(16)6-7-14(17)18/h3,5,8,12H,2,4,6-7H2,1H3,(H,17,18)
• InChIKey: KSHMLERHMKIIQC-UHFFFAOYSA-N

Properties

• Density: 1.281g/cm³ (Cal.)
• Boiling point: 523.401°C at 760 mmHg (Cal.)
• Flash point: 198.87°C (Cal.)
• Refractive index: 1.561 (Cal.)