Basic information
- CAS
736-26-5- Standard SMILES
O=Nc1ccc(NNC(=O)c2ccncc2)c(=O)cc1- InChIKey
MQDAALFMMPMHAN-UHFFFAOYSA-N- Molecular formula
- C13H10N4O3
- Average molar mass
- 270.24 g/mol
- Monoisotopic mass
- 270.07529019
Names & identifiers
- Preferred name
- 2-Isonicotinoylhydrazino-5-nitrosotropone
- IUPAC
- N'-(4-nitroso-7-oxocyclohepta-1,3,5-trien-1-yl)pyridine-4-carbohydrazide
Names & synonyms
736-26-5RCH-172BRN 04864502-Isonicotinoylhydrazino-5-nitrosotroponeISONICOTINIC ACID, 2-(4-NITROSO-7-OXO-1,3,5-CYCLOHEPTATRIEN-1-YL)HYDRAZIDEDTXSID502237874-Pyridinecarboxylic acid, 2-(4-nitroso-7-oxo-1,3,5-cycloheptatrien-1-yl)hydrazideNSC 527516RefChem:262332DTXCID80146278NSC527516N'-(4-nitroso-7-oxocyclohepta-1,3,5-trien-1-yl)pyridine-4-carbohydrazide
Show more names
NSC-527516
Database identifiers
- CAS
736-26-5- PubChem CID
- 12913
- DTXSID
DTXSID50223787
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 502
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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