Basic information
- CAS
750512-98-2- Standard SMILES
N#[N+]c1cccnc1[O-]- InChIKey
IXIBNTWRLWOKCL-UHFFFAOYSA-N- Molecular formula
- C5H3N3O
- Average molar mass
- 121.1 g/mol
- Monoisotopic mass
- 121.02761173
Names & identifiers
- Preferred name
- 3-Diazoniopyridin-2-olate
- IUPAC
- 3-diazoniopyridin-2-olate
Names & synonyms
3-diazoniopyridin-2-olate750512-98-2DTXSID60621518RefChem:278916DTXCID005722723-diazo-2(3h)-pyridoneSCHEMBL1254660
Database identifiers
- CAS
750512-98-2- PubChem CID
- 22015441
- DTXSID
DTXSID60621518- Nikkaji
- J513.124C
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 64.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 138
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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