7-Methyl-4,5,6,7-Tetrahydro-2-Oxepinecarboxylic Acid
[CAS# 419565-47-2]

Identification

• Name: 7-Methyl-4,5,6,7-Tetrahydro-2-Oxepinecarboxylic Acid
• Synonyms: 2-OXEPINCARBOXYLICACID, 4,5,6,7-TETRAHYDRO-7-METHYL-; 7-methyl-4,5,6,7-tetrahydrooxepine-2-carboxylic acid
• Molecular Formula: C₈H₁₂O₃
• Molecular Weight: 156.18
• CAS Registry Number: 419565-47-2
• SMILES: O=C(O)C=1OC(C)CCCC=1
• InChI: 1S/C8H12O3/c1-6-4-2-3-5-7(11-6)8(9)10/h5-6H,2-4H2,1H3,(H,9,10)
• InChIKey: HKHODUZAQNLSFN-UHFFFAOYSA-N

Properties

• Density: 1.126g/cm³ (Cal.)
• Boiling point: 284.037°C at 760 mmHg (Cal.)
• Flash point: 115.382°C (Cal.)
• Refractive index: 1.483 (Cal.)