Basic information
- CAS
63618-62-2- Standard SMILES
Cn1ccc2oc([N+](=O)[O-])cc2c1=O- InChIKey
NACSBIYXACZYCH-UHFFFAOYSA-N- Molecular formula
- C8H6N2O4
- Average molar mass
- 194.14 g/mol
- Monoisotopic mass
- 194.03275668
Names & identifiers
- Preferred name
- 5-Methyl-2-nitrofuro[3,2-c]pyridin-4(5H)-one
- IUPAC
- 5-methyl-2-nitrofuro[3,2-c]pyridin-4-one
Names & synonyms
5-Methyl-2-nitrofuro[3,2-c]pyridin-4(5H)-oneDTXSID60125796163618-62-2
Database identifiers
- CAS
63618-62-2- PubChem CID
- 12378891
- DTXSID
DTXSID601257961
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 79.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 309
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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