3-(1-Piperazinyl)-1,2-benzisothiazole (CAS 87691-87-0) — formula C11H13N3S, molecular weight 219.31; category organic chemicals.
| CAS Number | 87691-87-0 |
|---|---|
| Molecular Formula | C11H13N3S |
| Molecular Weight | 219.31 |
| LogP | 2.14 |
| Category | Organic Chemicals|Pharmaceutical Raw Materials |
3-(1-Piperazinyl)-1,2-benzisothiazole is a carbon-based organic compound with CAS registry number 87691-87-0 and molecular formula C11H13N3S (molecular weight 219.31), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 87691-87-0
Its molecular formula C11H13N3S comprises 11 C, 13 H, 3 N, 1 S atoms.
Also known as: 3-(1-Piperazinyl)-1,2-benzisothiazole · 3-(1-哌嗪基)-1,2-苯并异噻唑
Category: organic chemicals / pharmaceutical intermediates and APIs
The CAS registry number of 3-(1-Piperazinyl)-1,2-benzisothiazole is 87691-87-0.
Molecular formula C11H13N3S, molecular weight 219.31.
It is also registered under: 3-(1-Piperazinyl)-1,2-benzisothiazole, 3-(1-哌嗪基)-1,2-苯并异噻唑.
Category: Organic Chemicals / Pharmaceutical Raw Materials.
Independent reference data for 3-(1-Piperazinyl)-1,2-benzisothiazole (CAS 87691-87-0), compiled from public chemistry databases.
| CAS Registry Number | 87691-87-0 |
|---|---|
| PubChem CID | 2772144 |
| Molecular formula | C11H13N3S |
| IUPAC name | 3-piperazin-1-yl-1,2-benzothiazole |
| UNII (FDA) | 59D8RAT1F9 |
| Molecular Weight | 219.31 |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 219.08301860 |
| Monoisotopic Mass | 219.08301860 |
| Topological Polar Surface Area | 56.4 |
| Heavy Atom Count | 15 |
| LogP | 2.14 |
|---|
3-(1-Piperazinyl)-1,2-benzisothiazole; 87691-87-0; 3-(piperazin-1-yl)benzo[d]isothiazole; 3-Piperazin-1-yl-benzo[d]isothiazole; 1,2-Benzisothiazole, 3-(1-piperazinyl)-; N-(3-Benzisothiazolyl)piperazine; UNII-59D8RAT1F9; 3-Piperazin-1-yl-benzo(d)isothiazole; 3-PIPERAZIN-1-YL-1,2-BENZISOTHIAZOLE; 3-(Piperazin-1-yl)benzo(d)isothiazole; 59D8RAT1F9; ID-11614; MJ-14069; ZIPRASIDONE (M5); LURASIDONE METABOLITE M1; DTXSID70236556
| GHS notification summary | 2% (1 / 49) |
|---|
| GHS notification summary | 2% (1 / 49) |
|---|---|
| Reported hazard statements | H301 (85.7%), H315 (89.8%), H319 (98%) |
This chemical does not meet GHS hazard criteria for 2% (1 of 49) of reports.
H301 (85.7%): Toxic if swallowed [Danger Acute toxicity, oral]
3-(1-Piperazinyl)-1,2-benzisothiazole · CAS 87691-87-0 · C11H13N3S. UNII 59D8RAT1F9. LogP: 2.14.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-(1-哌嗪基)-1,2-苯并异噻唑