2-iminotetrahydro-8a,3-(epoxymethano)chromene-3,4,4(2H,4aH)-tricarbonitrile
9-imino-10,11-dioxatricyclo[6.2.2.01,6]dodecane-7,7,8-tricarbonitrile
Also Known As: imino[?]tricarbonitrile|NCI60_029314|SR-01000772219-2|2-iminotetrahydro-8a,3-(epoxymethano)chromene-3,4,4(2H,4aH)-tricarbonitrile|2-iminohexahydro-8a,3-(epoxymethano)chromene-3,4,4(4aH)-tricarbonitrile|8a,3-(Epoxymethano)-8aH-1-benzopyran-3,4,4(2H,6H)-tricarbonitrile, tetrahydro-2-imino-|9-Imino-10,11-dioxa-tricyclo[6.2.2.0*1,6*]dodecane-7,7,8-tricarbonitrile
| Molecular Formula | C13H12N4O2 |
|---|---|
| Molecular Weight | 256.09604 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 256.09604 |
| Monoisotopic Mass | 256.09604 |
| Heavy Atoms | 19 |
| Complexity | 598.0 |
Chemical Identifiers
| CAS Number | 95059-20-4 |
|---|---|
| SMILES | C1CCC23C(C1)C(C(CO2)(C(=N)O3)C#N)(C#N)C#N |
| InChIKey | UNPBKPAANJMRCG-UHFFFAOYSA-N |
Product Overview
2-iminotetrahydro-8a,3-(epoxymethano)chromene-3,4,4(2H,4aH)-tricarbonitrile (CAS 95059-20-4), with molecular formula C13H12N4O2 and molecular weight 256.09604 g/mol. IUPAC: 9-imino-10,11-dioxatricyclo[6.2.2.01,6]dodecane-7,7,8-tricarbonitrile.
2-iminotetrahydro-8a,3-(epoxymethano)chromene-3,4,4(2H,4aH)-tricarbonitrile is a custom synthesis product. We offer services from milligram to kilogram scale.
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