NSC286717
3-tert-butyl-1-[4-(3-tert-butyl-3-cyano-4-oxospiro[azetidine-2,9'-fluorene]-1-yl)phenyl]-4-oxospiro[azetidine-2,9'-fluorene]-3-carbonitrile
Also Known As: Spiro(azetidine-2,9'-(9H)fluorene)-3-carbonitrile, 1,1'-(1,4-phenylene)bis(3-(1,1-dimethylethyl)-4-oxo-|3-tert-butyl-1-[4-(3-tert-butyl-3-cyano-4-oxospiro[azetidine|1,1''-(1,4-Phenylene)bis(3-tert-butyl-4-oxospiro[azetidine-2,9'-fluorene]-3-carbonitrile)|1,1'-(1,4-Phenylene)bis(3-tert-butyl-4-oxospiro[azetidine-2,9'-fluorene]-3-carbonitrile)|3-tert-butyl-1-[4-(3-tert-butyl-3-cyano-4-oxo-spiro[azetidine-2,9'-fluorene]-1-yl)phenyl]-4-oxo-spiro[azetidine-2,9'-fluorene]-3-carbonitrile|3-tert-butyl-1-[4-(3-tert-butyl-3-cyano-4-oxospiro[azetidine-2,9'-fluorene]-1-yl)phenyl]-4-oxospiro[azetidine-2,9'-fluorene]-3-carbonitrile|Spiro[azetidine-2,9'-[9H]fluorene]-3-carbonitrile, 1,1'-(1,4-phenylene)bis[3-(1,1-dimethylethyl)-4-oxo-
| Molecular Formula | C46H38N4O2 |
|---|---|
| Molecular Weight | 678.2995 g/mol |
| LogP | 8.6 |
| Topological Polar Surface Area | 88.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 678.2995 |
| Monoisotopic Mass | 678.2995 |
| Heavy Atoms | 52 |
| Complexity | 1430.0 |
Chemical Identifiers
| CAS Number | 68161-26-2 |
|---|---|
| SMILES | CC(C)(C)C1(C(=O)N(C12C3=CC=CC=C3C4=CC=CC=C24)C5=CC=C(C=C5)N6C(=O)C(C67C8=CC=CC=C8C9=CC=CC=C79)(C#N)C(C)(C)C)C#N |
| InChIKey | CKGQAJDWWVYXRF-UHFFFAOYSA-N |
Product Overview
NSC286717 (CAS 68161-26-2), with molecular formula C46H38N4O2 and molecular weight 678.2995 g/mol. IUPAC: 3-tert-butyl-1-[4-(3-tert-butyl-3-cyano-4-oxospiro[azetidine-2,9'-fluorene]-1-yl)phenyl]-4-oxospiro[azetidine-2,9'-fluorene]-3-carbonitrile.
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