(6E)-6-[(1-Adamantylamino)Methylidene]-4-Hydroxycyclohexa-2,4-Dien-1-One
[CAS# 112851-89-5]

Identification

• Name: (6E)-6-[(1-Adamantylamino)Methylidene]-4-Hydroxycyclohexa-2,4-Dien-1-One
• Synonyms: (6E)-6-[(1-Adamantylamino)Methylene]-4-Hydroxy-Cyclohexa-2,4-Dien-1-One; (6E)-6-[(1-Adamantylamino)Methylene]-4-Hydroxy-1-Cyclohexa-2,4-Dienone; (6E)-6-[(1-Adamantylamino)Methylidene]-4-Hydroxy-Cyclohexa-2,4-Dien-1-One
• Molecular Formula: C₁₇H₂₁NO₂
• Molecular Weight: 271.36
• CAS Registry Number: 112851-89-5
• SMILES: O=C4/C(=C/NC12CC3CC(C1)CC(C2)C3)C=C(O)C=C4
• InChI: 1S/C17H21NO2/c19-15-1-2-16(20)14(6-15)10-18-17-7-11-3-12(8-17)5-13(4-11)9-17/h1-2,6,10-13,18-19H,3-5,7-9H2/b14-10+
• InChIKey: ZULRQIBVKNFUAS-GXDHUFHOSA-N

Properties

• Density: 1.247g/cm³ (Cal.)
• Boiling point: 402.17°C at 760 mmHg (Cal.)
• Flash point: 197.026°C (Cal.)