Basic information
- Standard SMILES
CC(C)(C)OC(=O)c1ccc(-c2cc3ccccc3o2)cc1- InChIKey
KSSQSUNOYDBANR-UHFFFAOYSA-N- Molecular formula
- C19H18O3
- Average molar mass
- 294.3 g/mol
- Monoisotopic mass
- 294.12559443
Names & identifiers
- Preferred name
- Tert-butyl 4-(benzofuran-2-yl)benzoate
- IUPAC
- tert-butyl 4-(1-benzofuran-2-yl)benzoate
Names & synonyms
SCHEMBL14966822KSSQSUNOYDBANR-UHFFFAOYSA-Ntert-butyl 4-(benzofuran-2-yl)benzoate
Database identifiers
- PubChem CID
- 89580933
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 39.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 390
Related reactions
2 records
Compound notes
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