RefChem:372037
1-(3-chlorobenzo[b][1]benzothiepin-6-yl)-4-methylpiperazine;methanesulfonic acid
Also Known As: Piperazine, 1-(2-chlorodibenzo(b,f)thiepin-10-yl)-4-methyl-, monomethanesulfonate|1-(2-Chlorodibenzo(b,f)thiepin-10-yl)-4-methylpiperazine methanesulfonate|1-(3-chlorobenzo[b][1]benzothiepin-6-yl)-4-methylpiperazine; methanesulfonic acid|Methanesulfonic acid--1-(2-chlorodibenzo[b,f]thiepin-10-yl)-4-methylpiperazine (1/1)
CAS: 58722-75-1
| Molecular Formula | C20H23ClN2O3S2 |
|---|---|
| Molecular Weight | 438.08386 g/mol |
| LogP | 4.0541 |
| Topological Polar Surface Area | 60.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 438.08386 |
| Monoisotopic Mass | 438.08386 |
| Heavy Atoms | 28 |
| Complexity | 976.6954 |
Chemical Identifiers
| CAS Number | 58722-75-1 |
|---|---|
| SMILES | CN1CCN(CC1)C2=CC3=C(C=CC(=C3)Cl)SC4=CC=CC=C42.CS(=O)(=O)O |
Product Overview
RefChem:372037 (CAS 58722-75-1), with molecular formula C20H23ClN2O3S2 and molecular weight 438.08386 g/mol. IUPAC: 1-(3-chlorobenzo[b][1]benzothiepin-6-yl)-4-methylpiperazine;methanesulfonic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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