RefChem:118728
3-ethyl-2-[2-(1-ethyl-2,5-dimethylpyrrol-3-yl)ethenyl]-1,3-benzoxazol-3-ium chloride
Also Known As: EINECS 263-960-1|3-ethyl-2-[2- vinyl]benzoxazoliumchloride|Benzoxazolium, 3-ethyl-2-(2-(1-ethyl-2,5-dimethyl-1H-pyrrol-3-yl)ethenyl)-, chloride|Benzoxazolium, 3-ethyl-2-(2-(1-ethyl-2,5-dimethyl-1H-pyrrol-3-yl)ethenyl)-, chloride (1:1)|Benzoxazolium, 3-ethyl-2-[2-(1-ethyl-2,5-dimethyl-1H-pyrrol-3-yl)ethenyl]-, chloride|3-Ethyl-2-(2-(1-ethyl-2,5-dimethyl-1H-pyrrol-3-yl)vinyl)benzoxazolium chloride|3-ethyl-2-[2-(1-ethyl-2,5-dimethyl-1H-pyrrol-3-yl)vinyl]benzoxazolium chloride|Benzoxazolium, 3-ethyl-2-[2-(1-ethyl-2,5-dimethyl-1H-pyrrol-3-yl)ethenyl]-, chloride (1:1)|3-ethyl-2-[2-(1-ethyl-2,5-dimethylpyrrol-3-yl)ethenyl]-1,3-benzoxazol-3-ium chloride|3-ethyl-2-[2-(1-ethyl-2,5-dimethylpyrrol-3-yl)ethenyl]-1,3-benzoxazol-3-ium,chloride|3-Ethyl-2-[2-(1-ethyl-2,5-dimethyl-1H-pyrrol-3-yl)ethen-1-yl]-1,3-benzoxazol-3-ium chloride
| Molecular Formula | C19H23ClN2O |
|---|---|
| Molecular Weight | 330.1499 g/mol |
| LogP | 1.35 |
| Topological Polar Surface Area | 21.95 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.1499 |
| Heavy Atoms | 23 |
| Complexity | 842.5 |
Chemical Identifiers
| CAS Number | 63149-22-4 |
|---|---|
| SMILES | CCN1C(=CC(=C1C)C=CC2=[N+](C3=CC=CC=C3O2)CC)C.[Cl-] |
Product Overview
RefChem:118728 (CAS 63149-22-4), with molecular formula C19H23ClN2O and molecular weight 330.1499 g/mol. IUPAC: 3-ethyl-2-[2-(1-ethyl-2,5-dimethylpyrrol-3-yl)ethenyl]-1,3-benzoxazol-3-ium chloride.
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