AC1MXD58
13-imino-10-phenyl-11,12-dioxatricyclo[6.3.2.01,7]tridecane-8,9,9-tricarbonitrile
Also Known As: 11-imino-2-phenylhexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile|13-Imino-10-phenyl-11,12-dioxatricyclo[6.3.2.01,7]tridecane-8,9,9-tricarbonitrile|13-Imino-10-phenyl-11,12-dioxa-tricyclo[6.3.2.0*1,7*]tridecane-8,9,9-tricarbonitrile|11-imino-2-phenylhexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4(4H)-tricarbonitrile
| Molecular Formula | C20H18N4O2 |
|---|---|
| Molecular Weight | 346.14297 g/mol |
| LogP | 3.58551 |
| Topological Polar Surface Area | 113.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 346.14297 |
| Monoisotopic Mass | 346.14297 |
| Heavy Atoms | 26 |
| Complexity | 863.80273 |
Chemical Identifiers
| CAS Number | 1164552-56-0 |
|---|---|
| SMILES | C1CCC2C3(CC1)OC(C(C2(C(=N)O3)C#N)(C#N)C#N)C4=CC=CC=C4 |
Product Overview
AC1MXD58 (CAS 1164552-56-0), with molecular formula C20H18N4O2 and molecular weight 346.14297 g/mol. IUPAC: 13-imino-10-phenyl-11,12-dioxatricyclo[6.3.2.01,7]tridecane-8,9,9-tricarbonitrile.
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