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Basic information
- Standard SMILES
COC(=O)C1CCc2c(OCc3ccccc3)cccc2C1=O- InChIKey
FLAUSWDSUBUNFY-UHFFFAOYSA-N- Molecular formula
- C19H18O4
- Average molar mass
- 310.3 g/mol
- Monoisotopic mass
- 310.12050905
Names & identifiers
- Preferred name
- 5-(Benzyloxy)-2-(methoxycarbonyl)-1-tetralone
- IUPAC
- methyl 1-oxo-5-phenylmethoxy-3,4-dihydro-2H-naphthalene-2-carboxylate
Names & synonyms
SCHEMBL5210991FLAUSWDSUBUNFY-UHFFFAOYSA-NDB-1094095-(benzyloxy)-2-(methoxycarbonyl)-1-tetralone475086-70-5
Database identifiers
- PubChem CID
- 22932001
Properties
Computed structural propertiesFilling in
- XLogP
- 3.6
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 427
Related reactions
4 records
Compound notes
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