Basic information
- CAS
62811-53-4- Standard SMILES
COc1ccc2c(=O)c(C)c(C3CCC3)oc2c1- InChIKey
FPPPTYYNXQRDAS-UHFFFAOYSA-N- Molecular formula
- C15H16O3
- Average molar mass
- 244.28 g/mol
- Monoisotopic mass
- 244.10994437
Names & identifiers
- Preferred name
- 2-Cyclobutyl-7-methoxy-3-methyl-4H-1-benzopyran-4-one
- IUPAC
- 2-cyclobutyl-7-methoxy-3-methylchromen-4-one
Names & synonyms
62811-53-4NSC3205852-Cyclobutyl-7-methoxy-3-methyl-4H-1-benzopyran-4-oneDTXSID10317792NSC-320585
Database identifiers
- CAS
62811-53-4- PubChem CID
- 330910
- DTXSID
DTXSID10317792
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 381
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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