Basic information
- CAS
36161-48-5- Standard SMILES
O=C(Cn1ccc(=O)[nH]c1=O)c1ccco1- InChIKey
BRYALPNGGNIOOH-UHFFFAOYSA-N- Molecular formula
- C10H8N2O4
- Average molar mass
- 220.18 g/mol
- Monoisotopic mass
- 220.04840674
Names & identifiers
- Preferred name
- 1-[2-(Furan-2-yl)-2-oxoethyl]pyrimidine-2,4-dione
- IUPAC
- 1-[2-(furan-2-yl)-2-oxoethyl]pyrimidine-2,4-dione
Names & synonyms
NSC16657836161-48-5SCHEMBL19370628DTXSID60304637AKOS011299118NSC-1665781-[2-(Furan-2-yl)-2-oxoethyl]pyrimidine-2,4(1H,3H)-dione
Database identifiers
- CAS
36161-48-5- PubChem CID
- 296428
- DTXSID
DTXSID60304637
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 79.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 364
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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