2,3,4,5-tetrahydro-1-benzothiepin-5-one (CAS 21609-70-1) — formula C10H10OS, molecular weight 178.25; category organic chemicals.
| CAS Number | 21609-70-1 |
|---|---|
| Molecular Formula | C10H10OS |
| Molecular Weight | 178.25 |
| LogP | 2.3 |
| Category | Organic Chemicals |
2,3,4,5-tetrahydro-1-benzothiepin-5-one is a carbon-based organic compound with CAS registry number 21609-70-1 and molecular formula C10H10OS (molecular weight 178.25), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 21609-70-1
Its molecular formula C10H10OS comprises 10 C, 10 H, 1 O, 1 S atoms.
Also known as: 2,3,4,5-tetrahydro-1-benzothiepin-5-one · 3,4-二氢-2H-苯并[B]硫杂卓-5-酮
Category: organic chemicals
The CAS registry number of 2,3,4,5-tetrahydro-1-benzothiepin-5-one is 21609-70-1.
Molecular formula C10H10OS, molecular weight 178.25.
It is also registered under: 2,3,4,5-tetrahydro-1-benzothiepin-5-one, 3,4-二氢-2H-苯并[B]硫杂卓-5-酮.
Category: Organic Chemicals.
Independent reference data for 2,3,4,5-tetrahydro-1-benzothiepin-5-one (CAS 21609-70-1), compiled from public chemistry databases.
| CAS 号 | 21609-70-1 |
|---|---|
| PubChem CID | 345956 |
| 分子式 | C10H10OS |
| IUPAC 名称 | 3,4-dihydro-2H-1-benzothiepin-5-one |
| UNII（FDA） | Z384973676 |
| Molecular Weight | 178.25 |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 178.04523611 |
| Monoisotopic Mass | 178.04523611 |
| Topological Polar Surface Area | 42.4 |
| Heavy Atom Count | 12 |
21609-70-1; 2,3,4,5-tetrahydro-1-benzothiepin-5-one; 3,4-dihydro-2h-benzo[b]thiepin-5-one; 3,4-dihydrobenzo[b]thiepin-5(2H)-one; 3,4-dihydro-2H-1-benzothiepin-5-one; 3,4-dihydro-1-benzothiepin-5(2H)-one; MFCD00090357; C10H10OS; NSC403933; 2,3-Dihydro-1-benzothiepin-5(4H)-one; SCHEMBL1551445; DTXSID40323402; WKSQUBWTMSEHDF-UHFFFAOYSA-N; WAA60970; AKOS005216506; NSC-403933
| 已通报的危害声明 | H302 (100%), H315 (100%), H319 (100%), H335 (100%) |
|---|
3,4-二氢-2H-苯并[B]硫杂卓-5-酮 · CAS 21609-70-1 · C10H10OS. UNII Z384973676.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3,4-二氢-2H-苯并[B]硫杂卓-5-酮