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Basic information
- Standard SMILES
CC(C)(C)OC(=O)COc1cccc2c1CCC[C@@H]2O- InChIKey
MAKPERXFYOZKOJ-ZDUSSCGKSA-N- Molecular formula
- C16H22O4
- Average molar mass
- 278.34 g/mol
- Monoisotopic mass
- 278.15180918
Names & identifiers
- Preferred name
- ((S)-5-Hydroxy-5,6,7,8-tetrahydro-naphthalen-1-yloxy)-acetic acid tert-butyl ester
- IUPAC
- tert-butyl 2-[[(5S)-5-hydroxy-5,6,7,8-tetrahydronaphthalen-1-yl]oxy]acetate
Names & synonyms
SCHEMBL1835786MAKPERXFYOZKOJ-ZDUSSCGKSA-N((S)-5-Hydroxy-5,6,7,8-tetrahydro-naphthalen-1-yloxy)-acetic acid tert-butyl ester
Database identifiers
- PubChem CID
- 59192543
Properties
Computed structural propertiesFilling in
- XLogP
- 2.7
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 334
Related reactions
2 records
Compound notes
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