2-Nitro-N-[5-nitro-1-(2-nitro-benzoyl)-1H-benzo[c]isothiazol-(3Z)-ylidene]-benzamide structure
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Common Name | 2-Nitro-N-[5-nitro-1-(2-nitro-benzoyl)-1H-benzo[c]isothiazol-(3Z)-ylidene]-benzamide | ||
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| CAS Number | 106532-76-7 | Molecular Weight | 493.40600 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C21H11N5O8S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | 2-Nitro-N-[5-nitro-1-(2-nitro-benzoyl)-1H-benzo[c]isothiazol-(3Z)-ylidene]-benzamide |
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| Molecular Formula | C21H11N5O8S |
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| Molecular Weight | 493.40600 |
| Exact Mass | 493.03300 |
| PSA | 217.13000 |
| LogP | 5.42660 |
| InChIKey | KTUJCZWYAJFUJS-UHFFFAOYSA-N |
| SMILES | O=C(N=c1sn(C(=O)c2ccccc2[N+](=O)[O-])c2ccc([N+](=O)[O-])cc12)c1ccccc1[N+](=O)[O-] |