5,6,7,8-Tetrahydro-3-nitronaphthalen-2-ol-1-carboxylic acid, methyl ester
methyl 2-hydroxy-3-nitro-5,6,7,8-tetrahydronaphthalene-1-carboxylate
Also Known As: methyl 2-hydroxy-3-nitro-5,6,7,8-tetrahydro-1-naphthoate|5,6,7,8-Tetrahydro-3-nitronaphthalen-2-ol-1-carboxylic acid, methyl ester|Methyl 2-hydroxy-3-nitro-5,6,7,8-tetrahydro-1-naphthalenecarboxylate|Methyl 2-hydroxy-3-nitro-5,6,7,8-tetrahydro-1-naphthalenecarboxylate #|methyl 2-hydroxy-3-nitro-5,6,7,8-tetrahydronaphthalene-1-carboxylate
| Molecular Formula | C12H13NO5 |
|---|---|
| Molecular Weight | 251.07938 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 92.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.07938 |
| Monoisotopic Mass | 251.07938 |
| Heavy Atoms | 18 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 89586-23-2 |
|---|---|
| SMILES | COC(=O)C1=C2CCCCC2=CC(=C1O)[N+](=O)[O-] |
| InChIKey | RDEAYQFBOCIQOC-UHFFFAOYSA-N |
Product Overview
5,6,7,8-Tetrahydro-3-nitronaphthalen-2-ol-1-carboxylic acid, methyl ester (CAS 89586-23-2), with molecular formula C12H13NO5 and molecular weight 251.07938 g/mol. IUPAC: methyl 2-hydroxy-3-nitro-5,6,7,8-tetrahydronaphthalene-1-carboxylate.
5,6,7,8-Tetrahydro-3-nitronaphthalen-2-ol-1-carboxylic acid, methyl ester is a custom synthesis product. We offer services from milligram to kilogram scale.
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