5H-(2)Benzopyrano(3,4-g)(2,3)dihydro-(1,4)benzodioxin-5-one
Basic information
- CAS
128650-15-7- Standard SMILES
O=c1oc2cc3c(cc2c2c1=CCCC=2)OC=CO3- InChIKey
WWPOSUFPEHREJA-UHFFFAOYSA-N- Molecular formula
- C15H10O4
- Average molar mass
- 254.24 g/mol
- Monoisotopic mass
- 254.0579088
Names & identifiers
- Preferred name
- 5H-(2)Benzopyrano(3,4-g)(2,3)dihydro-(1,4)benzodioxin-5-one
- IUPAC
- 2,3-dihydroisochromeno[3,4-g][1,4]benzodioxin-5-one
Names & synonyms
128650-15-75H-(2)Benzopyrano(3,4-g)(2,3)dihydro-(1,4)benzodioxin-5-oneDTXSID709261822,3-Dihydro-5H-[2]benzopyrano[3,4-g][1,4]benzodioxin-5-one
Database identifiers
- CAS
128650-15-7- PubChem CID
- 148111
- DTXSID
DTXSID70926182
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 502
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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