Basic information
- CAS
134924-79-1- Standard SMILES
Cc1cc(=O)n(C)c(-c2ccc(C)o2)n1- InChIKey
AIYFCBGHGPMPFT-UHFFFAOYSA-N- Molecular formula
- C11H12N2O2
- Average molar mass
- 204.22 g/mol
- Monoisotopic mass
- 204.08987763
Names & identifiers
- Preferred name
- 4(3H)-Pyrimidinone, 3,6-dimethyl-2-(5-methyl-2-furanyl)-
- IUPAC
- 3,6-dimethyl-2-(5-methylfuran-2-yl)pyrimidin-4-one
Names & synonyms
134924-79-13,6-Dimethyl-2-(5-methyl-furan-2-yl)uracil4(3H)-Pyrimidinone, 3,6-dimethyl-2-(5-methyl-2-furanyl)-DTXSID401590813,6-dimethyl-2-(5-methyl-2-furyl)pyrimidin-4-one3,6-Dimethyl-2-(5-methylfuran-2-yl)pyrimidin-4(3H)-one
Database identifiers
- CAS
134924-79-1- PubChem CID
- 453097
- DTXSID
DTXSID40159081
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 346
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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