HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 68217618Generated: October 30, 2026
(E)-ethyl 2-cyano-2-(5-fluoro-2,3-dihydro-1H-inden-1-ylidene)acetate
https://huagongshe.com/en/chemical/68217618
Identifiers & Physical Properties
| Molecular formula | C14H12FNO2 |
|---|
| Average molar mass | 245.25 g/mol |
|---|
| Monoisotopic mass | 245.08520679 g/mol |
|---|
| SMILES | CCOC(=O)/C(C#N)=C1\CCc2cc(F)ccc21 |
|---|
| InChIKey | CBKYVUNPQDUXJK-OUKQBFOZSA-N |
|---|
| PubChem CID | 68217618 |
|---|
Chemical & Physical Properties
| XLogP | 2.5 |
|---|
| Topological polar surface area | 50.1 |
|---|
| Hydrogen bond donors | 0 |
|---|
| Hydrogen bond acceptors | 4 |
|---|
| Rotatable bonds | 3 |
|---|
| Heavy atoms | 18 |
|---|
| Formal charge | 0 |
|---|
| Complexity | 421 |
|---|
