Basic information
- CAS
50639-52-6- Standard SMILES
COCc1c2ccoc2c(OC)c2oc(=O)ccc12- InChIKey
ADISAXBOSWJNRL-UHFFFAOYSA-N- Molecular formula
- C14H12O5
- Average molar mass
- 260.24 g/mol
- Monoisotopic mass
- 260.06847348
Names & identifiers
- Preferred name
- 7H-Furo(3,2-g)(1)benzopyran-7-one, 9-methoxy-4-(methoxymethyl)-
- IUPAC
- 9-methoxy-4-(methoxymethyl)furo[3,2-g]chromen-7-one
Names & synonyms
7H-Furo(3,2-g)(1)benzopyran-7-one, 9-methoxy-4-(methoxymethyl)-50639-52-69-Methoxy-4-(methoxymethyl)-7H-furo(3,2-g)(1)benzopyran-7-one9-Methoxy-4-(methoxymethyl)-7H-furo[3,2-g][1]benzopyran-7-oneCHEMBL6835DTXSID10198684
Database identifiers
- CAS
50639-52-6- PubChem CID
- 148503
- DTXSID
DTXSID10198684- ChEMBL
CHEMBL6835- Nikkaji
- J1.059.367K
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 57.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 380
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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