Basic information
- Standard SMILES
CCCCOC(=O)CCOc1ccc(C(C)(C)C)cc1- InChIKey
CFMATNLQVOOIEI-UHFFFAOYSA-N- Molecular formula
- C17H26O3
- Average molar mass
- 278.4 g/mol
Names & identifiers
- Preferred name
- Butyl 3-(p-tert-butylphenoxy)-propionate
- IUPAC
- butyl 3-(4-tert-butylphenoxy)propanoate
Names & synonyms
SCHEMBL9593375CFMATNLQVOOIEI-UHFFFAOYSA-Nbutyl 3-(p-tert-butylphenoxy)-propionatebutyl 3-(p-tert-butyl-phenoxy)-propionate
Database identifiers
- PubChem CID
- 14423333
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 272
Related reactions
11 records
Linked notes
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