1-benzyl-6-methoxy-2-[[3-(4-sulphonatobutyl)-3H-benzoselenazol-2-ylidene]methyl]quinolinium (CAS 63815-75-8) — formula C29H28N2O4SSe, molecular weight 579.6; category organic chemicals.
| CAS Number | 63815-75-8 |
|---|---|
| Molecular Formula | C29H28N2O4SSe |
| Molecular Weight | 579.6 |
| Category | Organic Chemicals |
1-benzyl-6-methoxy-2-[[3-(4-sulphonatobutyl)-3H-benzoselenazol-2-ylidene]methyl]quinolinium is a carbon-based organic compound with CAS registry number 63815-75-8 and molecular formula C29H28N2O4SSe (molecular weight 579.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 63815-75-8
Its molecular formula C29H28N2O4SSe comprises 29 C, 28 H, 2 N, 4 O, 1 S, 1 Se atoms.
Also known as: 1-benzyl-6-methoxy-2-[[3-(4-sulphonatobutyl)-3H-benzoselenazol-2-ylidene]methyl]quinolinium · 1-苄基-6-甲氧基-2-[[3-(4-磺基丁基)-3H-苯并硒唑-2-亚基]甲基]喹啉鎓
Category: organic chemicals
The CAS registry number of 1-benzyl-6-methoxy-2-[[3-(4-sulphonatobutyl)-3H-benzoselenazol-2-ylidene]methyl]quinolinium is 63815-75-8.
Molecular formula C29H28N2O4SSe, molecular weight 579.6.
It is also registered under: 1-benzyl-6-methoxy-2-[[3-(4-sulphonatobutyl)-3H-benzoselenazol-2-ylidene]methyl]quinolinium, 1-苄基-6-甲氧基-2-[[3-(4-磺基丁基)-3H-苯并硒唑-2-亚基]甲基]喹啉鎓.
Category: Organic Chemicals.
Independent reference data for 1-benzyl-6-methoxy-2-[[3-(4-sulphonatobutyl)-3H-benzoselenazol-2-ylidene]methyl]quinolinium (CAS 63815-75-8), compiled from public chemistry databases.
| CAS 号 | 63815-75-8 |
|---|---|
| PubChem CID | 113880 |
| 分子式 | C29H28N2O4SSe |
| IUPAC 名称 | 4-[2-[(1-benzyl-6-methoxyquinolin-1-ium-2-yl)methylidene]-1,3-benzoselenazol-3-yl]butane-1-sulfonate |
| UNII（FDA） | NS00087275 |
| Molecular Weight | 579.6 |
|---|---|
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 8 |
| Exact Mass | 580.09350 |
| Monoisotopic Mass | 580.09350 |
| Topological Polar Surface Area | 81.9 |
| Heavy Atom Count | 37 |
63815-75-8; EINECS 264-475-8; Quinolinium, 6-methoxy-1-(phenylmethyl)-2-((3-(4-sulfobutyl)-2(3H)-benzoselenazolylidene)methyl)-, inner salt; Quinolinium, 6-methoxy-1-(phenylmethyl)-2-[[3-(4-sulfobutyl)-2(3H)-benzoselenazolylidene]methyl]-, inner salt; RefChem:178316; 1-Benzyl-6-methoxy-2-((3-(4-sulphonatobutyl)-3H-benzoselenazol-2-ylidene)methyl)quinolinium; ZTHVSASDZJTOBJ-UHFFFAOYSA-N; DTXSID501109008; NS00087275
1-苄基-6-甲氧基-2-[[3-(4-磺基丁基)-3H-苯并硒唑-2-亚基]甲基]喹啉鎓 · CAS 63815-75-8 · C29H28N2O4SSe. UNII NS00087275.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.