(E)-but-2-enedioic acid,1-(2,3-dichlorobenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine structure
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Common Name | (E)-but-2-enedioic acid,1-(2,3-dichlorobenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine | ||
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| CAS Number | 60811-05-4 | Molecular Weight | 493.40300 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C23H22Cl2N2O4S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | (E)-but-2-enedioic acid,1-(2,3-dichlorobenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine |
|---|
| Molecular Formula | C23H22Cl2N2O4S |
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| Molecular Weight | 493.40300 |
| Exact Mass | 492.06800 |
| PSA | 106.38000 |
| LogP | 4.79110 |
| InChIKey | HNJSAUUDUTVXPY-WLHGVMLRSA-N |
| SMILES | CN1CCN(C2=Cc3ccccc3Sc3cc(Cl)c(Cl)cc32)CC1.O=C(O)C=CC(=O)O |