About 1-(2-fluorophenyl)dodecylhydrazine
1-(2-fluorophenyl)dodecylhydrazine (PubChem CID 105292285) has the molecular formula C18H31FN2
and a molecular weight of 294.46 g/mol. Its IUPAC name is 1-(2-fluorophenyl)dodecylhydrazine.
Molecular Properties
| Compound Name | 1-(2-fluorophenyl)dodecylhydrazine |
| PubChem CID | 105292285 |
| Molecular Formula | C18H31FN2 |
| Molecular Weight | 294.46 g/mol |
| Exact Mass | 294.25 |
| IUPAC Name | 1-(2-fluorophenyl)dodecylhydrazine |
| SMILES | CCCCCCCCCCCC(NN)c1ccccc1F |
| InChI | InChI=1S/C18H31FN2/c1-2-3-4-5-6-7-8-9-10-15-18(21-20)16-13-11-12-14-17(16)19/h11-14,18,21H,2-10,15,20H2,1H3 |
| InChIKey | BNTLXWHPLWFUDJ-UHFFFAOYSA-N |
| XLogP | 5.25 |
| TPSA | 38.05 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 12 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 294.46 |
| LogP ≤ 5 | 5.25 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 1-(2-fluorophenyl)dodecylhydrazine?
The IUPAC name of 1-(2-fluorophenyl)dodecylhydrazine (CID 105292285) is 1-(2-fluorophenyl)dodecylhydrazine.
What is the SMILES notation for 1-(2-fluorophenyl)dodecylhydrazine?
The canonical SMILES for 1-(2-fluorophenyl)dodecylhydrazine is CCCCCCCCCCCC(NN)c1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)dodecylhydrazine?
The InChIKey is BNTLXWHPLWFUDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31FN2/c1-2-3-4-5-6-7-8-9-10-15-18(21-20)16-13-11-12-14-17(16)19/h11-14,18,21H,2-10,15,20H2,1H3.
What are the key properties of 1-(2-fluorophenyl)dodecylhydrazine?
1-(2-fluorophenyl)dodecylhydrazine has a molecular weight of 294.46 g/mol, XLogP of 5.25, 12 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)dodecylhydrazine is sourced from PubChem (CID 105292285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).