5-Butyl-7-methoxy-1-benzofuran-4-yl acetate
Basic information
- CAS
99107-57-0- Standard SMILES
CCCCc1cc(OC)c2occc2c1OC(C)=O- InChIKey
XNORXWDTASPCJP-UHFFFAOYSA-N- Molecular formula
- C15H18O4
- Average molar mass
- 262.3 g/mol
- Monoisotopic mass
- 262.12050905
Names & identifiers
- Preferred name
- 5-Butyl-7-methoxy-1-benzofuran-4-yl acetate
- IUPAC
- (5-butyl-7-methoxy-1-benzofuran-4-yl) acetate
Names & synonyms
99107-57-05-butyl-7-methoxy-1-benzofuran-4-yl acetateCHEMBL165681DTXSID109128624-Benzofuranol, 5-butyl-7-methoxy-, 4-acetate
Database identifiers
- CAS
99107-57-0- PubChem CID
- 188490
- DTXSID
DTXSID10912862- ChEMBL
CHEMBL165681- Nikkaji
- J273.615B
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 48.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 305
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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