2-[4-(acetylphenylamino)buta-1,3-dienyl]-3-ethylbenzoxazolium iodide (CAS 5217-54-9) — formula C21H21IN2O2, molecular weight 460.3; category organic chemicals.
| CAS Number | 5217-54-9 |
|---|---|
| Molecular Formula | C21H21IN2O2 |
| Molecular Weight | 460.3 |
| Category | Organic Chemicals |
2-[4-(acetylphenylamino)buta-1,3-dienyl]-3-ethylbenzoxazolium iodide is a carbon-based organic compound with CAS registry number 5217-54-9 and molecular formula C21H21IN2O2 (molecular weight 460.3), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 5217-54-9
Its molecular formula C21H21IN2O2 comprises 21 C, 21 H, 1 I, 2 N, 2 O atoms.
Also known as: 2-[4-(acetylphenylamino)buta-1,3-dienyl]-3-ethylbenzoxazolium iodide · 2-[4-(乙酰基苯基氨基)丁-1,3-二烯基]-3-乙基苯并恶唑鎓碘化物
Category: organic chemicals
The CAS registry number of 2-[4-(acetylphenylamino)buta-1,3-dienyl]-3-ethylbenzoxazolium iodide is 5217-54-9.
Molecular formula C21H21IN2O2, molecular weight 460.3.
It is also registered under: 2-[4-(acetylphenylamino)buta-1,3-dienyl]-3-ethylbenzoxazolium iodide, 2-[4-(乙酰基苯基氨基)丁-1,3-二烯基]-3-乙基苯并恶唑鎓碘化物.
Category: Organic Chemicals.
Independent reference data for 2-[4-(acetylphenylamino)buta-1,3-dienyl]-3-ethylbenzoxazolium iodide (CAS 5217-54-9), compiled from public chemistry databases.
| CAS 号 | 5217-54-9 |
|---|---|
| PubChem CID | 111046 |
| 分子式 | C21H21IN2O2 |
| IUPAC 名称 | N-[4-(3-ethyl-1,3-benzoxazol-3-ium-2-yl)buta-1,3-dienyl]-N-phenylacetamide iodide |
| UNII（FDA） | NS00044711 |
| Molecular Weight | 460.3 |
|---|---|
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 460.06478 |
| Monoisotopic Mass | 460.06478 |
| Topological Polar Surface Area | 37.3 |
| Heavy Atom Count | 26 |
5217-54-9; DTXSID30884138; Benzoxazolium, 2-[4-(acetylphenylamino)-1,3-butadienyl]-3-ethyl-, iodide; Benzoxazolium, 2-[4-(acetylphenylamino)-1,3-butadien-1-yl]-3-ethyl-, iodide (1:1); EINECS 226-011-2; Benzoxazolium, 2-(4-(acetylphenylamino)-1,3-butadienyl)-3-ethyl-, iodide; Benzoxazolium, 2-(4-(acetylphenylamino)-1,3-butadien-1-yl)-3-ethyl-, iodide (1:1); RefChem:118711; DTXCID401023605; SCHEMBL10479057; RKHTYMDCAAQJBN-UHFFFAOYSA-M; NS00044711; 3-ETHYL-2-[4-(N-PHENYLACETAMIDO)BUTA-1,3-DIEN-1-YL]-1,3-BENZOXAZOL-3-IUM IODIDE
2-[4-(乙酰基苯基氨基)丁-1,3-二烯基]-3-乙基苯并恶唑鎓碘化物 · CAS 5217-54-9 · C21H21IN2O2. UNII NS00044711.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.