Ethyl 2-hydroxy-2H-pyrrolo[3,2-c]pyridazine-6-carboxylate
Basic information
- CAS
50872-80-5- Standard SMILES
CCOC(=O)c1cc2nn(O)ccc-2n1- InChIKey
ZJJMXVUOSKNIEE-UHFFFAOYSA-N- Molecular formula
- C9H9N3O3
- Average molar mass
- 207.19 g/mol
- Monoisotopic mass
- 207.06439116
Names & identifiers
- Preferred name
- Ethyl 2-hydroxy-2H-pyrrolo[3,2-c]pyridazine-6-carboxylate
- IUPAC
- ethyl 2-hydroxypyrrolo[3,2-c]pyridazine-6-carboxylate
Names & synonyms
50872-80-5NSC193021DTXSID20307583Ethyl 2-hydroxy-2H-pyrrolo[3,2-c]pyridazine-6-carboxylateNSC-193021
Database identifiers
- CAS
50872-80-5- PubChem CID
- 303660
- DTXSID
DTXSID20307583
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 77.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 249
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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