2,3-dihydro-1,5-benzothiazepin-4(5H)-one (CAS 53454-43-6) — formula C9H9NOS, molecular weight 179.24; category organic chemicals.
| CAS Number | 53454-43-6 |
|---|---|
| Molecular Formula | C9H9NOS |
| Molecular Weight | 179.24 |
| LogP | 1.3 |
| Category | Organic Chemicals |
2,3-dihydro-1,5-benzothiazepin-4(5H)-one is a carbon-based organic compound with CAS registry number 53454-43-6 and molecular formula C9H9NOS (molecular weight 179.24), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 53454-43-6
Its molecular formula C9H9NOS comprises 9 C, 9 H, 1 N, 1 O, 1 S atoms.
Also known as: 2,3-dihydro-1,5-benzothiazepin-4(5H)-one · 2,3-二氢-1,5-苯并硫氮杂卓-4(5H)-酮
Category: organic chemicals
The CAS registry number of 2,3-dihydro-1,5-benzothiazepin-4(5H)-one is 53454-43-6.
Molecular formula C9H9NOS, molecular weight 179.24.
It is also registered under: 2,3-dihydro-1,5-benzothiazepin-4(5H)-one, 2,3-二氢-1,5-苯并硫氮杂卓-4(5H)-酮.
Category: Organic Chemicals.
Independent reference data for 2,3-dihydro-1,5-benzothiazepin-4(5H)-one (CAS 53454-43-6), compiled from public chemistry databases.
| CAS Registry Number | 53454-43-6 |
|---|---|
| PubChem CID | 96471 |
| Molecular formula | C9H9NOS |
| IUPAC name | 3,5-dihydro-2H-1,5-benzothiazepin-4-one |
| UNII (FDA) | F1BZY09GXA |
| Molecular Weight | 179.24 |
|---|---|
| XLogP3 | 1.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 179.04048508 |
| Monoisotopic Mass | 179.04048508 |
| Topological Polar Surface Area | 54.4 |
| Heavy Atom Count | 12 |
53454-43-6; 2,3-Dihydro-1,5-benzothiazepin-4(5H)-one; 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-; F1BZY09GXA; NSC 75690; BRN 0145791; UNII-F1BZY09GXA; NSC-75690; DTXSID80201619; 4-27-00-02753 (Beilstein Handbook Reference); 4-OXO-2,3,4,5-TETRAHYDROBENZO(B)(1,4)THIAZEPINE; RefChem:81660; DTXCID60124110; 611-001-6; VNUDPFLTWOKTKQ-UHFFFAOYSA-N; 3,5-dihydro-2H-1,5-benzothiazepin-4-one
| Reported hazard statements | H302 (100%), H315 (100%), H319 (100%), H335 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
2,3-dihydro-1,5-benzothiazepin-4(5H)-one · CAS 53454-43-6 · C9H9NOS. UNII F1BZY09GXA.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.