[1-ethoxy-3-(4-hydroxy-2-methyl-5-oxofuro[3,2-g]chromen-9-yl)oxypropan-2-yl]-diethylazanium chloride
[1-ethoxy-3-(4-hydroxy-2-methyl-5-oxofuro[3,2-g]chromen-9-yl)oxypropan-2-yl]-diethylazanium chloride
| Molecular Formula | C21H28ClNO6 |
|---|---|
| Molecular Weight | 425.9 g/mol |
| Topological Polar Surface Area | 82.6 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 425.16052 |
| Heavy Atoms | 29 |
| Complexity | 551.0 |
Chemical Identifiers
| CAS Number | 96577-66-1 |
|---|---|
| SMILES | CC[NH+](CC)C(COCC)COC1=C2C(=C(C3=C1OC=CC3=O)O)C=C(O2)C.[Cl-] |
| InChIKey | RDDGTKHXFBZFOO-UHFFFAOYSA-N |
📖 Product Overview
[1-ethoxy-3-(4-hydroxy-2-methyl-5-oxofuro[3,2-g]chromen-9-yl)oxypropan-2-yl]-diethylazanium chloride (CAS: 96577-66-1) is a chemical compound with molecular formula C21H28ClNO6 and molecular weight 425.9 g/mol. Its IUPAC systematic name is [1-ethoxy-3-(4-hydroxy-2-methyl-5-oxofuro[3,2-g]chromen-9-yl)oxypropan-2-yl]-diethylazanium chloride.
RDDGTKHXFBZFOO-UHFFFAOYSA-N.
SMILES: CC[NH+](CC)C(COCC)COC1=C2C(=C(C3=C1OC=CC3=O)O)C=C(O2)C.[Cl-].
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