C12H11Cl2FN2S — CID 105217959
[1-(4-chloro-2-fluorophenyl)-2-(5-chlorothiophen-2-yl)ethyl]hydrazine (PubChem CID 105217959) has the molecular formula C12H11Cl2FN2S and a molecular weight of 305.21 g/mol. Its IUPAC name is [1-(4-chloro-2-fluorophenyl)-2-(5-chlorothiophen-2-yl)ethyl]hydrazine.
| Compound Name | [1-(4-chloro-2-fluorophenyl)-2-(5-chlorothiophen-2-yl)ethyl]hydrazine |
|---|---|
| PubChem CID | 105217959 |
| Molecular Formula | C12H11Cl2FN2S |
| Molecular Weight | 305.21 g/mol |
| Exact Mass | 304.00 |
| IUPAC Name | [1-(4-chloro-2-fluorophenyl)-2-(5-chlorothiophen-2-yl)ethyl]hydrazine |
| SMILES | NNC(Cc1ccc(Cl)s1)c1ccc(Cl)cc1F |
| InChI | InChI=1S/C12H11Cl2FN2S/c13-7-1-3-9(10(15)5-7)11(17-16)6-8-2-4-12(14)18-8/h1-5,11,17H,6,16H2 |
| InChIKey | HKAWOEUBWFFQHT-UHFFFAOYSA-N |
| XLogP | 3.94 |
| TPSA | 38.05 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 18 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 305.21 |
| LogP ≤ 5 | 3.94 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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