Basic information
- Standard SMILES
CCOC(=O)c1c(F)cnn1CC- InChIKey
RKZXGFPKKFMYAD-UHFFFAOYSA-N- Molecular formula
- C8H11FN2O2
- Average molar mass
- 186.18 g/mol
Names & identifiers
- Preferred name
- ethyl 1-ethyl-4-fluoro-1H-pyrazole-5-carboxylate
- IUPAC
- ethyl 1-ethyl-4-fluoropyrazole-5-carboxylate
Names & synonyms
SCHEMBL1430949RKZXGFPKKFMYAD-UHFFFAOYSA-Nethyl 1-ethyl-4-fluoro-1H-pyrazole-5-carboxylate
Database identifiers
- PubChem CID
- 58356399
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 44.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 189
Related reactions
2 records
Compound notes
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