1-Naphthaleneacetic acid, 1,2,3,4-tetrahydro-2-oxo-, methyl ester
methyl 2-(2-oxo-3,4-dihydro-1H-naphthalen-1-yl)acetate
Also Known As: Methyl (2-oxo-1,2,3,4-tetrahydro-1-naphthalenyl)acetate|methyl 2-(2-oxo-3,4-dihydro-1H-naphthalen-1-yl)acetate|Methyl (2-oxo-1,2,3,4-tetrahydro-1-naphthalenyl)acetate #|Methyl 2-(2-oxo-1,2,3,4-tetrahydronaphthalen-1-yl)acetate|1,2,3,4-Tetrahydro-2-oxo-1-naphthalene acetic acid methyl ester|1-Naphthaleneacetic acid, 1,2,3,4-tetrahydro-2-oxo-, methyl ester
| Molecular Formula | C13H14O3 |
|---|---|
| Molecular Weight | 218.0943 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.0943 |
| Monoisotopic Mass | 218.0943 |
| Heavy Atoms | 16 |
| Complexity | 285.0 |
Chemical Identifiers
| CAS Number | 7531-31-9 |
|---|---|
| SMILES | COC(=O)CC1C(=O)CCC2=CC=CC=C12 |
| InChIKey | AVLHEBLMJQSCNH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Naphthaleneacetic acid, 1,2,3,4-tetrahydro-2-oxo-, methyl ester (CAS 7531-31-9), with molecular formula C13H14O3 and molecular weight 218.0943 g/mol. IUPAC: methyl 2-(2-oxo-3,4-dihydro-1H-naphthalen-1-yl)acetate.
1-Naphthaleneacetic acid, 1,2,3,4-tetrahydro-2-oxo-, methyl ester is a custom synthesis product. We offer services from milligram to kilogram scale.
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