3-methyl-2-[2-[(3-methyl-3H-benzothiazol-2-ylidene)methyl]but-1-enyl]benzothiazolium iodide (CAS 47450-63-5) — formula C21H21IN2S2, molecular weight 492.4; category organic chemicals.
| CAS Number | 47450-63-5 |
|---|---|
| Molecular Formula | C21H21IN2S2 |
| Molecular Weight | 492.4 |
| Category | Organic Chemicals |
3-methyl-2-[2-[(3-methyl-3H-benzothiazol-2-ylidene)methyl]but-1-enyl]benzothiazolium iodide is a carbon-based organic compound with CAS registry number 47450-63-5 and molecular formula C21H21IN2S2 (molecular weight 492.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 47450-63-5
Its molecular formula C21H21IN2S2 comprises 21 C, 21 H, 1 I, 2 N, 2 S atoms.
Also known as: 3-methyl-2-[2-[(3-methyl-3H-benzothiazol-2-ylidene)methyl]but-1-enyl]benzothiazolium iodide · 3-甲基-2-[2-[(3-甲基-3H-苯并噻唑-2-亚基)甲基]丁-1-烯基]苯并噻唑碘化物
Category: organic chemicals
The CAS registry number of 3-methyl-2-[2-[(3-methyl-3H-benzothiazol-2-ylidene)methyl]but-1-enyl]benzothiazolium iodide is 47450-63-5.
Molecular formula C21H21IN2S2, molecular weight 492.4.
It is also registered under: 3-methyl-2-[2-[(3-methyl-3H-benzothiazol-2-ylidene)methyl]but-1-enyl]benzothiazolium iodide, 3-甲基-2-[2-[(3-甲基-3H-苯并噻唑-2-亚基)甲基]丁-1-烯基]苯并噻唑碘化物.
Category: Organic Chemicals.
Independent reference data for 3-methyl-2-[2-[(3-methyl-3H-benzothiazol-2-ylidene)methyl]but-1-enyl]benzothiazolium iodide (CAS 47450-63-5), compiled from public chemistry databases.
| CAS 号 | 47450-63-5 |
|---|---|
| PubChem CID | 13980949 |
| 分子式 | C21H21IN2S2 |
| IUPAC 名称 | (2Z)-3-methyl-2-[(2E)-2-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylidene]butylidene]-1,3-benzothiazole iodide |
| Molecular Weight | 492.4 |
|---|---|
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 492.01909 |
| Monoisotopic Mass | 492.01909 |
| Topological Polar Surface Area | 60.7 |
| Heavy Atom Count | 26 |
47450-63-5; EINECS 256-315-0; 3-Methyl-2-(2-((3-methyl-3H-benzothiazol-2-ylidene)methyl)but-1-enyl)benzothiazolium iodide; 3-METHYL-2-[2-[(3-METHYL-3H-BENZOTHIAZOL-2-YLIDENE)METHYL]BUT-1-ENYL]BENZOTHIAZOLIUM IODIDE
3-甲基-2-[2-[(3-甲基-3H-苯并噻唑-2-亚基)甲基]丁-1-烯基]苯并噻唑碘化物 · CAS 47450-63-5 · C21H21IN2S2.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.