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Basic information
- Standard SMILES
COC(=O)C1=Cc2cccc(OCc3ccccc3)c2CC1- InChIKey
DLRRSVQSSVKECU-UHFFFAOYSA-N- Molecular formula
- C19H18O3
- Average molar mass
- 294.3 g/mol
- Monoisotopic mass
- 294.12559443
Names & identifiers
- Preferred name
- 5-(Benzyloxy)-2-(methoxycarbonyl)-3,4-dihydronaphthalene
- IUPAC
- methyl 5-phenylmethoxy-3,4-dihydronaphthalene-2-carboxylate
Names & synonyms
SCHEMBL5219492DLRRSVQSSVKECU-UHFFFAOYSA-NDB-1071485-(benzyloxy)-2-(methoxycarbonyl)-3,4-dihydronaphthalene475086-72-7
Database identifiers
- PubChem CID
- 22932012
Properties
Computed structural propertiesFilling in
- XLogP
- 4
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 409
Related reactions
4 records
Compound notes
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