Ethyl 6-chloro-4-(trifluoromethyl)pyridazine-3-carboxylate
Basic information
- CAS
184956-75-0- Standard SMILES
CCOC(=O)c1nnc(Cl)cc1C(F)(F)F- InChIKey
HNBQQHGYKIODSK-UHFFFAOYSA-N- Molecular formula
- C8H6ClF3N2O2
- Average molar mass
- 254.59 g/mol
- Monoisotopic mass
- 254.0069896
Names & identifiers
- Preferred name
- Ethyl 6-chloro-4-(trifluoromethyl)pyridazine-3-carboxylate
- IUPAC
- ethyl 6-chloro-4-(trifluoromethyl)pyridazine-3-carboxylate
Names & synonyms
ethyl 6-chloro-4-(trifluoromethyl)pyridazine-3-carboxylateHNBQQHGYKIODSK-UHFFFAOYSA-NDTXSID501194645184956-75-0Ethyl 6-chloro-4-(trifluoromethyl)-3-pyridazinecarboxylate
Database identifiers
- CAS
184956-75-0- PubChem CID
- 85706350
- DTXSID
DTXSID501194645
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 52.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 262
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Compound notes
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