1-(2-Acetyl-7-methoxy-1-benzofuran-4-yl)hexan-1-one
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Basic information
- CAS
59445-72-6- Standard SMILES
CCCCCC(=O)c1ccc(OC)c2oc(C(C)=O)cc12- InChIKey
BNWRATYAQIXMIE-UHFFFAOYSA-N- Molecular formula
- C17H20O4
- Average molar mass
- 288.34 g/mol
- Monoisotopic mass
- 288.13615911
Names & identifiers
- Preferred name
- 1-(2-Acetyl-7-methoxy-1-benzofuran-4-yl)hexan-1-one
- IUPAC
- 1-(2-acetyl-7-methoxy-1-benzofuran-4-yl)hexan-1-one
Names & synonyms
59445-72-61-(2-acetyl-7-methoxy-1-benzofuran-4-yl)hexan-1-oneNSC205055DTXSID00308573NSC-205055
Database identifiers
- CAS
59445-72-6- PubChem CID
- 307204
- DTXSID
DTXSID00308573
Properties
Computed structural propertiesFilling in
- XLogP
- 3.9
- Topological polar surface area
- 56.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 379
Related reactions
0 records
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Compound notes
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