RefChem:319193
[2-[(5-methoxy-1,3-dioxo-2-phenylinden-2-yl)methoxy]-2-oxoethyl]-trimethylazanium chloride
Also Known As: RefChem:319193|AC1L215D|2-Trimethylammoniumacetoxymethyl-2-phenyl-5-methoxyindan-1,3-dione chloride|(1,3-Dioxo-5-methoxy-2-phenylindan-2-yl(methoxycarbonyl)methyl)trimethylammonium chloride|Ammonium, carboxymethyltrimethyl-, chloride ester with 2-hydroxymethyl-5-methoxy-2-phenyl-1,3-indandione|[2-[(5-Methoxy-1,3-dioxo-2-phenylinden-2-yl)methoxy]-2-oxoethyl]-trimethylazaniumchloride|[2-[(5-methoxy-1,3-dioxo-2-phenylinden-2-yl)methoxy]-2-oxoethyl]-trimethylazanium chloride|2-[(5-Methoxy-1,3-dioxo-2-phenyl-2,3-dihydro-1H-inden-2-yl)methoxy]-N,N,N-trimethyl-2-oxoethan-1-aminium chloride
| Molecular Formula | C22H24ClNO5 |
|---|---|
| Molecular Weight | 417.1343 g/mol |
| LogP | -0.73 |
| Topological Polar Surface Area | 69.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 417.1343 |
| Heavy Atoms | 29 |
| Complexity | 936.0 |
Chemical Identifiers
| CAS Number | 42223-02-9 |
|---|---|
| SMILES | C[N+](C)(C)CC(=O)OCC1(C(=O)C2=C(C1=O)C=C(C=C2)OC)C3=CC=CC=C3.[Cl-] |
Product Overview
RefChem:319193 (CAS 42223-02-9), with molecular formula C22H24ClNO5 and molecular weight 417.1343 g/mol. IUPAC: [2-[(5-methoxy-1,3-dioxo-2-phenylinden-2-yl)methoxy]-2-oxoethyl]-trimethylazanium chloride.
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