Basic information
- CAS
170165-03-4- Standard SMILES
CCOC(=O)c1cnncc1COc1ccccc1- InChIKey
VHOUYFOITICJFE-UHFFFAOYSA-N- Molecular formula
- C14H14N2O3
- Average molar mass
- 258.27 g/mol
- Monoisotopic mass
- 258.10044231
Names & identifiers
- Preferred name
- Ethyl 5-(phenoxymethyl)pyridazine-4-carboxylate
- IUPAC
- ethyl 5-(phenoxymethyl)pyridazine-4-carboxylate
Names & synonyms
Ethyl 5-(phenoxymethyl)pyridazine-4-carboxylate170165-03-4DTXSID70570109RefChem:344193DTXCID70520881
Database identifiers
- CAS
170165-03-4- PubChem CID
- 15212302
- DTXSID
DTXSID70570109- Nikkaji
- J660.878G
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 61.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 280
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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