AC1MII5I
5-O-(2-prop-2-enoxyethyl) 3-O-(2-propoxyethyl) 2-(hydroxymethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Also Known As: 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2-(hydroxymethyl)-6-methyl-4-(3-nitrophenyl)-, 5-(2-(2-propenyloxy)ethyl) 3-(2-propoxyethyl) ester|5-O-(2-prop-2-enoxyethyl) 3-O-(2-propoxyethyl) 2-(hydroxymethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate|3,5-Pyridinedicarboxylicacid,1,4-dihydro-2- -6-methyl-4- -,5-(2- 3- ester|3,5-Pyridinedicarboxylic acid,1,4-dihydro-2-(hydroxymethyl)-6-methyl-4-(3-nitrophenyl)-,5-(2-(2-propenyloxy)ethyl) 3-(2-propoxyethyl) ester|5-{2-[(Prop-2-en-1-yl)oxy]ethyl} 3-(2-propoxyethyl) 2-(hydroxymethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
| Molecular Formula | C25H32N2O9 |
|---|---|
| Molecular Weight | 504.2108 g/mol |
| LogP | 2.5176 |
| Topological Polar Surface Area | 146.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 15 |
| Exact Mass | 504.2108 |
| Monoisotopic Mass | 504.2108 |
| Heavy Atoms | 36 |
| Complexity | 1016.5372 |
Chemical Identifiers
| CAS Number | 85387-16-2 |
|---|---|
| SMILES | CCCOCCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCCOCC=C)C)CO |
Product Overview
AC1MII5I (CAS 85387-16-2), with molecular formula C25H32N2O9 and molecular weight 504.2108 g/mol. IUPAC: 5-O-(2-prop-2-enoxyethyl) 3-O-(2-propoxyethyl) 2-(hydroxymethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate.
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