2-[[3-(Carboxylatomethyl)benzothiazol-2(3H)-ylidene]methyl]-1-ethylquinolinium (CAS 53288-83-8) — formula C21H18N2O2S, molecular weight 362.4; category organic chemicals.
| CAS Number | 53288-83-8 |
|---|---|
| Molecular Formula | C21H18N2O2S |
| Molecular Weight | 362.4 |
| LogP | 5.4 |
| Category | Organic Chemicals |
2-[[3-(Carboxylatomethyl)benzothiazol-2(3H)-ylidene]methyl]-1-ethylquinolinium is a carbon-based organic compound with CAS registry number 53288-83-8 and molecular formula C21H18N2O2S (molecular weight 362.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 53288-83-8
Its molecular formula C21H18N2O2S comprises 21 C, 18 H, 2 N, 2 O, 1 S atoms.
Also known as: 2-[[3-(Carboxylatomethyl)benzothiazol-2(3H)-ylidene]methyl]-1-ethylquinolinium · 2-[[3-(羧基甲基)苯并噻唑-2(3H)-亚基]甲基]-1-乙基喹啉鎓
Category: organic chemicals
The CAS registry number of 2-[[3-(Carboxylatomethyl)benzothiazol-2(3H)-ylidene]methyl]-1-ethylquinolinium is 53288-83-8.
Molecular formula C21H18N2O2S, molecular weight 362.4.
It is also registered under: 2-[[3-(Carboxylatomethyl)benzothiazol-2(3H)-ylidene]methyl]-1-ethylquinolinium, 2-[[3-(羧基甲基)苯并噻唑-2(3H)-亚基]甲基]-1-乙基喹啉鎓.
Category: Organic Chemicals.
Independent reference data for 2-[[3-(Carboxylatomethyl)benzothiazol-2(3H)-ylidene]methyl]-1-ethylquinolinium (CAS 53288-83-8), compiled from public chemistry databases.
| CAS 号 | 53288-83-8 |
|---|---|
| PubChem CID | 103768 |
| 分子式 | C21H18N2O2S |
| IUPAC 名称 | 2-[2-[(1-ethylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-3-yl]acetate |
| Molecular Weight | 362.4 |
|---|---|
| XLogP3 | 5.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 362.10889899 |
| Monoisotopic Mass | 362.10889899 |
| Topological Polar Surface Area | 72.6 |
| Heavy Atom Count | 26 |
2-((3-(carboxymethyl)-2(3H)-benzothiazolylidene)methyl)-1-ethylquinolinium, inner salt; Quinolinium, 2-((3-(carboxymethyl)-2(3H)-benzothiazolylidene)methyl)-1-ethyl-, inner salt; 2-[[3-(carboxymethyl)-2(3H)-benzothiazolylidene]methyl]-1-ethylquinolinium, inner salt; Quinolinium, 2-[[3-(carboxymethyl)-2(3H)-benzothiazolylidene]methyl]-1-ethyl-, inner salt; DTXSID3068839; RefChem:178299; DTXCID7041386; 53288-83-8; ZDKFHCYNZYQJRJ-UHFFFAOYSA-N; DB-251090; 2-[[3-(Carboxylatomethyl)benzothiazol-2(3H)-ylidene]methyl]-1-ethylquinolinium
2-[[3-(羧基甲基)苯并噻唑-2(3H)-亚基]甲基]-1-乙基喹啉鎓 · CAS 53288-83-8 · C21H18N2O2S.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.