Basic information
- Standard SMILES
COCCOc1cc(C(C)=O)cc(C(C)(C)C)c1- InChIKey
HCAKPCQGMZTWMQ-UHFFFAOYSA-N- Molecular formula
- C15H22O3
- Average molar mass
- 250.33 g/mol
Names & identifiers
- Preferred name
- 1-[3-Tert-butyl-5-(2-methoxyethoxy)phenyl]ethanone
- IUPAC
- 1-[3-tert-butyl-5-(2-methoxyethoxy)phenyl]ethanone
Names & synonyms
SCHEMBL1188548HCAKPCQGMZTWMQ-UHFFFAOYSA-NDB-1909401-[3-tert-butyl-5-(2-methoxyethoxy)phenyl]ethanone1-[3-(1,1-Dimethylethyl)-5-(2-methoxyethoxy)phenyl]ethanone1178584-77-4
Database identifiers
- PubChem CID
- 58136808
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 267
Related reactions
10 records
Compound notes
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