1-(3-METHYL-4H-1,4-BENZOTHIAZIN-2-YL)ETHAN-1-ONE (CAS 31645-94-0) — formula C11H11NOS, molecular weight 205.28; category organic chemicals.
| CAS Number | 31645-94-0 |
|---|---|
| Molecular Formula | C11H11NOS |
| Molecular Weight | 205.28 |
| LogP | 2.5 |
| Category | Organic Chemicals |
1-(3-METHYL-4H-1,4-BENZOTHIAZIN-2-YL)ETHAN-1-ONE is a carbon-based organic compound with CAS registry number 31645-94-0 and molecular formula C11H11NOS (molecular weight 205.28), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 31645-94-0
Its molecular formula C11H11NOS comprises 11 C, 11 H, 1 N, 1 O, 1 S atoms.
Also known as: 1-(3-METHYL-4H-1,4-BENZOTHIAZIN-2-YL)ETHAN-1-ONE · 1-(3-甲基-4H-1,4-苯并噻嗪-2-基)乙烷-1-酮
Category: organic chemicals
The CAS registry number of 1-(3-METHYL-4H-1,4-BENZOTHIAZIN-2-YL)ETHAN-1-ONE is 31645-94-0.
Molecular formula C11H11NOS, molecular weight 205.28.
It is also registered under: 1-(3-METHYL-4H-1,4-BENZOTHIAZIN-2-YL)ETHAN-1-ONE, 1-(3-甲基-4H-1,4-苯并噻嗪-2-基)乙烷-1-酮.
Category: Organic Chemicals.
Independent reference data for 1-(3-METHYL-4H-1,4-BENZOTHIAZIN-2-YL)ETHAN-1-ONE (CAS 31645-94-0), compiled from public chemistry databases.
| CAS 号 | 31645-94-0 |
|---|---|
| PubChem CID | 595774 |
| 分子式 | C11H11NOS |
| IUPAC 名称 | 1-(3-methyl-4H-1,4-benzothiazin-2-yl)ethanone |
| UNII（FDA） | ST50004377 |
| Molecular Weight | 205.28 |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 205.05613515 |
| Monoisotopic Mass | 205.05613515 |
| Topological Polar Surface Area | 54.4 |
| Heavy Atom Count | 14 |
31645-94-0; 1-(3-methyl-4h-1,4-benzothiazin-2-yl)ethan-1-one; DTXSID00344294; RefChem:224510; DTXCID10295369; 1-(3-Methyl-4H-1,4-benzothiazin-2-yl)ethanone; 1-(3-methyl-4H-benzo[b][1,4]thiazin-2-yl)ethanone; 2-Acetyl-3-methyl-4H-1,4-benzothiazine; MFCD00053054; F1477-0024; 1-(3-methyl-4H-benzo[b][1,4]thiazin-2-yl)ethan-1-one; 2-acetyl-3-methyl-4H-benzo[b]1,4-thiazine; Maybridge1_003276; 1-(3-methyl-4H-1,4-benzothiazin-2-yl)-1-ethanone; HMS550M20; WBZVLPUFAVZNKB-UHFFFAOYSA-N
1-(3-甲基-4H-1,4-苯并噻嗪-2-基)乙烷-1-酮 · CAS 31645-94-0 · C11H11NOS. UNII ST50004377.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.