Acetic acid, [(7-oxo-7H-furo[3,2-g][1]benzopyran-9-yl)oxy]-, ethyl ester
Basic information
- CAS
103292-74-6- Standard SMILES
CCOC(=O)COc1c2occc2cc2ccc(=O)oc12- InChIKey
KJDUWVMPAAJEDC-UHFFFAOYSA-N- Molecular formula
- C15H12O6
- Average molar mass
- 288.25 g/mol
- Monoisotopic mass
- 288.0633881
Names & identifiers
- Preferred name
- Acetic acid, [(7-oxo-7H-furo[3,2-g][1]benzopyran-9-yl)oxy]-, ethyl ester
- IUPAC
- ethyl 2-(7-oxofuro[3,2-g]chromen-9-yl)oxyacetate
Names & synonyms
NSC601987Acetic acid, [(7-oxo-7H-furo[3,2-g][1]benzopyran-9-yl)oxy]-, ethyl esterCHEMBL1289911SCHEMBL20278633DTXSID90326569NSC-601987ethyl 2-((7-oxo-7h-furo[3,2-g]chromen-9-yl)oxy)acetateEthyl [(7-oxo-7H-furo[3,2-g][1]benzopyran-9-yl)oxy]acetate
Database identifiers
- CAS
103292-74-6- PubChem CID
- 353502
- DTXSID
DTXSID90326569- ChEMBL
CHEMBL1289911
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 75 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 445
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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