Pyridazinium, 1-(2-methoxy-2-oxoethyl)-, bromide
Basic information
- CAS
7593-56-8- Standard SMILES
COC(=O)C[n+]1ccccn1.[Br-]- InChIKey
SPUCPYKCBIUXNC-UHFFFAOYSA-M- Molecular formula
- C7H9BrN2O2
- Average molar mass
- 233.06 g/mol
- Monoisotopic mass
- 231.98474
Names & identifiers
- Preferred name
- Pyridazinium, 1-(2-methoxy-2-oxoethyl)-, bromide
- IUPAC
- methyl 2-pyridazin-1-ium-1-ylacetate bromide
Names & synonyms
7593-56-81-(2-METHOXY-2-OXOETHYL)PYRIDAZIN-1-IUM BROMIDE1-(2-Methoxy-2-oxoethyl)-1-pyridazinium BromidePyridazinium, 1-(2-methoxy-2-oxoethyl)-, bromideSCHEMBL16686411DTXSID70469822SY286050
Database identifiers
- CAS
7593-56-8- PubChem CID
- 11637224
- DTXSID
DTXSID70469822
Properties
Computed structural properties
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 138
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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