AC1L5WAH
3-ethoxycarbonyl-5-methoxycarbonyl-4-(3-methoxy-3-oxopropyl)-1H-pyrrole-2-carboxylic acid
Also Known As: N-METHYL-5-NITRO-FURAN-2-CARBOHYDRAZIDE|3-(ethoxycarbonyl)-5-(methoxycarbonyl)-4-(3-methoxy-3-oxopropyl)-1h-pyrrole-2-carboxylic acid|3-ethoxycarbonyl-5-methoxycarbonyl-4-(3-methoxy-3-oxopropyl)|3-ethoxycarbonyl-5-methoxycarbonyl-4-(3-methoxy-3-oxopropyl)-1H-pyrrole-2-carboxylic acid|3-(Ethoxycarbonyl)-4-(3-methoxy-3-oxopropyl)-5-(methoxycarbonyl)-1H-pyrrole-2-carboxylic acid
| Molecular Formula | C14H17NO8 |
|---|---|
| Molecular Weight | 327.09543 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 327.09543 |
| Monoisotopic Mass | 327.09543 |
| Heavy Atoms | 23 |
| Complexity | 477.0 |
Chemical Identifiers
| CAS Number | 7153-57-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=C1CCC(=O)OC)C(=O)OC)C(=O)O |
| InChIKey | CAEHABBBDAAEKJ-UHFFFAOYSA-N |
Product Overview
AC1L5WAH (CAS 7153-57-3), with molecular formula C14H17NO8 and molecular weight 327.09543 g/mol. IUPAC: 3-ethoxycarbonyl-5-methoxycarbonyl-4-(3-methoxy-3-oxopropyl)-1H-pyrrole-2-carboxylic acid.
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