Basic information
- Standard SMILES
COc1cc(C2CN(C(=O)OC(C)(C)C)C2)c(OC)nn1- InChIKey
MHXAKZBKGCDOCO-UHFFFAOYSA-N- Molecular formula
- C14H21N3O4
- Average molar mass
- 295.33 g/mol
Names & identifiers
- Preferred name
- Tert-butyl 3-(3,6-dimethoxypyridazin-4-yl)azetidine-1-carboxylate
- IUPAC
- tert-butyl 3-(3,6-dimethoxypyridazin-4-yl)azetidine-1-carboxylate
Database identifiers
- PubChem CID
- 44239657
- Nikkaji
- J2.761.040D
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 73.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 366
Related reactions
1 records
Compound notes
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