Basic information
- Standard SMILES
Cc1cc([N+](=O)[O-])cn(C)c1=O- InChIKey
QMSGHJNATYWTIA-UHFFFAOYSA-N- Molecular formula
- C7H8N2O3
- Average molar mass
- 168.15 g/mol
Names & identifiers
- Preferred name
- 1,3-dimethyl-5-nitropyridin-2(1H)-one
- IUPAC
- 1,3-dimethyl-5-nitropyridin-2-one
Names & synonyms
1,3-dimethyl-5-nitropyridin-2(1H)-one202278-26-01,3-dimethyl-5-nitro-1H-pyridin-2-oneSCHEMBL2573621QMSGHJNATYWTIA-UHFFFAOYSA-NAKOS0168287481,3-dimethyl-5-nitropyridin2(1h)-oneDB-121192G10960
Database identifiers
- PubChem CID
- 4657526
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 66.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 298
Related reactions
4 records
Compound notes
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