4-[2-(3,3-Dimethyl-3H-Indol-2-Yl)Ethenyl]Phenol
[CAS# 1980-93-4]

Identification

• Name: 4-[2-(3,3-Dimethyl-3H-Indol-2-Yl)Ethenyl]Phenol
• Synonyms: 4-[2-(3,3-Dimethyl-1H-Indol-2-Ylidene)Ethylidene]Cyclohexa-2,5-Dien-1-One; 4-[(2Z)-2-(3,3-Dimethylindolin-2-Ylidene)Ethylidene]Cyclohexa-2,5-Dien-1-One; 4-[2-(3,3-Dimethylindolin-2-Ylidene)Ethylidene]Cyclohexa-2,5-Dien-1-One
• Molecular Formula: C₁₈H₁₇NO
• Molecular Weight: 263.34
• CAS Registry Number: 1980-93-4
• SMILES: C2=C1C(\C(NC1=CC=C2)=C\C=C3C=CC(=O)C=C3)(C)C
• InChI: 1S/C18H17NO/c1-18(2)15-5-3-4-6-16(15)19-17(18)12-9-13-7-10-14(20)11-8-13/h3-12,19H,1-2H3/b17-12-
• InChIKey: ZBDWOHPDCDKXPK-ATVHPVEESA-N

Properties

• Density: 1.223g/cm³ (Cal.)
• Boiling point: 419.05°C at 760 mmHg (Cal.)
• Flash point: 152.937°C (Cal.)