2H-Furo(2,3-h)-1-benzopyran-2-one, 8,9-dimethyl-
Basic information
- CAS
78982-41-9- Standard SMILES
Cc1oc2ccc3ccc(=O)oc3c2c1C- InChIKey
JLAPWSNBHNHNRQ-UHFFFAOYSA-N- Molecular formula
- C13H10O3
- Average molar mass
- 214.22 g/mol
- Monoisotopic mass
- 214.06299418
Names & identifiers
- Preferred name
- 2H-Furo(2,3-h)-1-benzopyran-2-one, 8,9-dimethyl-
- IUPAC
- 8,9-dimethylfuro[2,3-h]chromen-2-one
Names & synonyms
4',5'-Dimethylangelicin2H-Furo(2,3-h)-1-benzopyran-2-one, 8,9-dimethyl-78982-41-9DTXSID60229477RefChem:268620DTXCID80151968SCHEMBL9119853CHEMBL1078131JLAPWSNBHNHNRQ-UHFFFAOYSA-N8,9-Dimethyl-2H-furo[2,3-H]chromen-2-one #8,9-Dimethyl-2H-furo[2,3-h][1]benzopyran-2-one2H-Furo[2,3-h][1]benzopyran-2-one, 8,9-dimethyl-
Database identifiers
- CAS
78982-41-9- PubChem CID
- 149758
- DTXSID
DTXSID60229477- ChEMBL
CHEMBL1078131- Nikkaji
- J442.590A
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 39.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 336
Experimental & physicochemical properties
LogP2.94
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…