Basic information
- Standard SMILES
COc1ccc(C(=O)OCc2ccc(O)cc2)cc1C(C)(C)C- InChIKey
VZLZNCAPRMJZOI-UHFFFAOYSA-N- Molecular formula
- C19H22O4
- Average molar mass
- 314.4 g/mol
- Monoisotopic mass
- 314.15180918
Names & identifiers
- Preferred name
- 4-(3-tert-Butyl-4-methoxybenzoyloxymethyl)phenol
- IUPAC
- (4-hydroxyphenyl)methyl 3-tert-butyl-4-methoxybenzoate
Names & synonyms
4-(3-tert-Butyl-4-methoxybenzoyloxymethyl)phenol4-[3-tert-Butyl-4-methoxybenzoyloxymethyl)phenolSCHEMBL8839343VZLZNCAPRMJZOI-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 21474530
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 379
Related reactions
7 records
Linked notes
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