Basic information
- Standard SMILES
COC(=O)C1CCc2c(OC)cccc2C1=O- InChIKey
NXUCSDSIUDHIJR-UHFFFAOYSA-N- Molecular formula
- C13H14O4
- Average molar mass
- 234.25 g/mol
Names & identifiers
- Preferred name
- 2-Methoxycarbonyl-5-methoxy-1-oxo-1,2,3,4-tetrahydronaphthalene
- IUPAC
- methyl 5-methoxy-1-oxo-3,4-dihydro-2H-naphthalene-2-carboxylate
Names & synonyms
SCHEMBL7777529NXUCSDSIUDHIJR-UHFFFAOYSA-N2-methoxycarbonyl-5-methoxy-1-oxo-1,2,3,4-tetrahydronaphthalenemethyl [5-methoxy-1-oxo-1,2,3,4-tetrahydro-2-naphthyl]formate
Database identifiers
- PubChem CID
- 19082459
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 313
Related reactions
5 records
Compound notes
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