Basic information
- Standard SMILES
COC(=O)Cc1cc(OCc2ccccc2)c2cc(F)ccc2c1C- InChIKey
MDNNNTFCRKGVEM-UHFFFAOYSA-N- Molecular formula
- C21H19FO3
- Average molar mass
- 338.4 g/mol
Names & identifiers
- Preferred name
- (4-Benzyloxy-6-fluoro-1-methyl-naphthalen-2-yl)-acetic acid methyl ester
- IUPAC
- methyl 2-(6-fluoro-1-methyl-4-phenylmethoxynaphthalen-2-yl)acetate
Names & synonyms
SCHEMBL2176856MDNNNTFCRKGVEM-UHFFFAOYSA-N(4-benzyloxy-6-fluoro-1-methyl-naphthalen-2-yl)-acetic acid methyl ester
Database identifiers
- PubChem CID
- 59326512
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 435
Related reactions
2 records
Compound notes
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