Basic information
- CAS
43111-10-0- Standard SMILES
COc1c2occc2c(CO)c2ccc(=O)oc12- InChIKey
BMOUFGSYQMAJTB-UHFFFAOYSA-N- Molecular formula
- C13H10O5
- Average molar mass
- 246.21 g/mol
- Monoisotopic mass
- 246.05282342
Names & identifiers
- Preferred name
- 7H-Furo(3,2-g)(1)benzopyran-7-one, 4-(hydroxymethyl)-9-methoxy-
- IUPAC
- 4-(hydroxymethyl)-9-methoxyfuro[3,2-g]chromen-7-one
Names & synonyms
7H-Furo(3,2-g)(1)benzopyran-7-one, 4-(hydroxymethyl)-9-methoxy-43111-10-04-(Hydroxymethyl)-9-methoxy-7H-furo(3,2-g)(1)benzopyran-7-one4-(Hydroxymethyl)-9-methoxy-7H-furo[3,2-g][1]benzopyran-7-oneCHEMBL6577DTXSID90195696
Database identifiers
- CAS
43111-10-0- PubChem CID
- 148463
- DTXSID
DTXSID90195696- ChEMBL
CHEMBL6577
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 68.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 366
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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