Basic information
- CAS
4846-32-6- Standard SMILES
O=C1NC(=O)c2cc3c(cc21)OCO3- InChIKey
WXYGGWKJYRLNCL-UHFFFAOYSA-N- Molecular formula
- C9H5NO4
- Average molar mass
- 191.14 g/mol
- Monoisotopic mass
- 191.02185764
Names & identifiers
- Preferred name
- 5H-1,3-Dioxolo[4,5-f]isoindole-5,7(6H)-dione
- IUPAC
- [1,3]dioxolo[4,5-f]isoindole-5,7-dione
Names & synonyms
5H-1,3-Dioxolo[4,5-f]isoindole-5,7(6H)-dione4846-32-6[1,3]dioxolo[4,5-f]isoindole-5,7-dioneNSC279522SCHEMBL7283744DTXSID50313995WXYGGWKJYRLNCL-UHFFFAOYSA-NAKOS005067071NSC-279522DS-0089732H,5H-[1,3]Dioxolo[4,5-f]isoindole-5,7(6H)-dione
Database identifiers
- CAS
4846-32-6- PubChem CID
- 322366
- DTXSID
DTXSID50313995
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 275
Related reactions
1 records
Compound notes
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