Basic information
- CAS
52036-17-6- Standard SMILES
O=C1NC(=O)C(=Cc2ccc3c(c2)OCO3)N1- InChIKey
GSTYGEGWJKJKQF-UHFFFAOYSA-N- Molecular formula
- C11H8N2O4
- Average molar mass
- 232.19 g/mol
- Monoisotopic mass
- 232.04840674
Names & identifiers
- Preferred name
- 2,4-Imidazolidinedione, 5-(1,3-benzodioxol-5-ylmethylene)-
- IUPAC
- 5-(1,3-benzodioxol-5-ylmethylidene)imidazolidine-2,4-dione
Names & synonyms
52036-17-62,4-Imidazolidinedione, 5-(1,3-benzodioxol-5-ylmethylene)-SCHEMBL10750926DTXSID903442035-[(2H-1,3-Benzodioxol-5-yl)methylidene]imidazolidine-2,4-dione
Database identifiers
- CAS
52036-17-6- PubChem CID
- 595065
- DTXSID
DTXSID90344203
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 393
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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