methyl 4,6-dihydroxy-2-methyl-3,4-dihydro-1H-isoquinoline-1-carboxylate
methyl 4,6-dihydroxy-2-methyl-3,4-dihydro-1H-isoquinoline-1-carboxylate
| Molecular Formula | C12H15NO4 |
|---|---|
| Molecular Weight | 237.25 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 70.0 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.10011 |
| Heavy Atoms | 17 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 23824-12-6 |
|---|---|
| SMILES | CN1CC(C2=C(C1C(=O)OC)C=CC(=C2)O)O |
| InChIKey | MEKWCZAUQSRYJM-UHFFFAOYSA-N |
📖 Product Overview
methyl 4,6-dihydroxy-2-methyl-3,4-dihydro-1H-isoquinoline-1-carboxylate (CAS: 23824-12-6) is a chemical compound with molecular formula C12H15NO4 and molecular weight 237.25 g/mol. Its IUPAC systematic name is methyl 4,6-dihydroxy-2-methyl-3,4-dihydro-1H-isoquinoline-1-carboxylate.
MEKWCZAUQSRYJM-UHFFFAOYSA-N.
SMILES: CN1CC(C2=C(C1C(=O)OC)C=CC(=C2)O)O.
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