3-ethyl-6-methoxy-5-methyl-2-[2-(methylthio)but-1-enyl]benzothiazolium iodide (CAS 63816-01-3) — formula C16H22INOS2, molecular weight 435.4; category organic chemicals.
| CAS Number | 63816-01-3 |
|---|---|
| Molecular Formula | C16H22INOS2 |
| Molecular Weight | 435.4 |
| Category | Organic Chemicals |
3-ethyl-6-methoxy-5-methyl-2-[2-(methylthio)but-1-enyl]benzothiazolium iodide is a carbon-based organic compound with CAS registry number 63816-01-3 and molecular formula C16H22INOS2 (molecular weight 435.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 63816-01-3
Its molecular formula C16H22INOS2 comprises 16 C, 22 H, 1 I, 1 N, 1 O, 2 S atoms.
Also known as: 3-ethyl-6-methoxy-5-methyl-2-[2-(methylthio)but-1-enyl]benzothiazolium iodide · 3-乙基-6-甲氧基-5-甲基-2-[2-(甲硫基)丁-1-烯基]苯并噻唑碘化物
Category: organic chemicals
The CAS registry number of 3-ethyl-6-methoxy-5-methyl-2-[2-(methylthio)but-1-enyl]benzothiazolium iodide is 63816-01-3.
Molecular formula C16H22INOS2, molecular weight 435.4.
It is also registered under: 3-ethyl-6-methoxy-5-methyl-2-[2-(methylthio)but-1-enyl]benzothiazolium iodide, 3-乙基-6-甲氧基-5-甲基-2-[2-(甲硫基)丁-1-烯基]苯并噻唑碘化物.
Category: Organic Chemicals.
Independent reference data for 3-ethyl-6-methoxy-5-methyl-2-[2-(methylthio)but-1-enyl]benzothiazolium iodide (CAS 63816-01-3), compiled from public chemistry databases.
| CAS 号 | 63816-01-3 |
|---|---|
| PubChem CID | 113902 |
| 分子式 | C16H22INOS2 |
| IUPAC 名称 | 3-ethyl-6-methoxy-5-methyl-2-(2-methylsulfanylbut-1-enyl)-1,3-benzothiazol-3-ium iodide |
| UNII（FDA） | NS00055697 |
| Molecular Weight | 435.4 |
|---|---|
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 435.01875 |
| Monoisotopic Mass | 435.01875 |
| Topological Polar Surface Area | 66.7 |
| Heavy Atom Count | 21 |
63816-01-3; DTXSID20886323; EINECS 264-485-2; Benzothiazolium, 3-ethyl-6-methoxy-5-methyl-2-(2-(methylthio)-1-buten-1-yl)-, iodide (1:1); Benzothiazolium, 3-ethyl-6-methoxy-5-methyl-2-(2-(methylthio)-1-butenyl)-, iodide; Benzothiazolium, 3-ethyl-6-methoxy-5-methyl-2-[2-(methylthio)-1-buten-1-yl]-, iodide (1:1); Benzothiazolium, 3-ethyl-6-methoxy-5-methyl-2-[2-(methylthio)-1-butenyl]-, iodide; RefChem:118654; DTXCID601025657; 3-Ethyl-6-methoxy-5-methyl-2-(2-(methylthio)but-1-enyl)benzothiazolium iodide; 3-ETHYL-6-METHOXY-5-METHYL-2-[2-(METHYLTHIO)BUT-1-ENYL]BENZOTHIAZOLIUM IODIDE; LMZNVANCBNRMPZ-UHFFFAOYSA-M; DB-218053; NS00055697; 3-Ethyl-6-methoxy-5-methyl-2-[2-(methylsulfanyl)but-1-en-1-yl]-1,3-benzothiazol-3-ium iodide
3-乙基-6-甲氧基-5-甲基-2-[2-(甲硫基)丁-1-烯基]苯并噻唑碘化物 · CAS 63816-01-3 · C16H22INOS2. UNII NS00055697.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.