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| Name | Hexahydro-7-[(4-Nitrophenyl)Methyl]-2H-Azepin-2-One |
|---|---|
| Synonyms | 7-[(4-Nitrophenyl)Methyl]-2-Azepanone; 7-(4-Nitrobenzyl)Azepan-2-One |
| Molecular Structure | ![CAS#: 68841-21-4, Hexahydro-7-[(4-Nitrophenyl)Methyl]-2H-Azepin-2-One](/moreStructures/68841-21-4.gif) |
| Molecular Formula | C13H16N2O3 |
| Molecular Weight | 248.28 |
| CAS Registry Number | 68841-21-4 |
| EINECS | 272-439-8 |
| SMILES | C2=C(CC1NC(=O)CCCC1)C=CC(=C2)[N+]([O-])=O |
| InChI | 1S/C13H16N2O3/c16-13-4-2-1-3-11(14-13)9-10-5-7-12(8-6-10)15(17)18/h5-8,11H,1-4,9H2,(H,14,16) |
| InChIKey | RPMRYTUFZUKBQL-UHFFFAOYSA-N |
| Density | 1.2g/cm3 (Cal.) |
|---|---|
| Boiling point | 480.711°C at 760 mmHg (Cal.) |
| Flash point | 244.525°C (Cal.) |
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| List of Reports Available for Hexahydro-7-[(4-Nitrophenyl)Methyl]-2H-Azepin-2-One |