About [(3-bromo-5-chlorophenyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine
[(3-bromo-5-chlorophenyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine (PubChem CID 107948431) has the molecular formula C13H10BrCl2FN2
and a molecular weight of 364.05 g/mol. Its IUPAC name is [(3-bromo-5-chlorophenyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine.
Molecular Properties
| Compound Name | [(3-bromo-5-chlorophenyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine |
| PubChem CID | 107948431 |
| Molecular Formula | C13H10BrCl2FN2 |
| Molecular Weight | 364.05 g/mol |
| Exact Mass | 361.94 |
| IUPAC Name | [(3-bromo-5-chlorophenyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine |
| SMILES | NNC(c1cc(Cl)cc(Br)c1)c1ccc(Cl)cc1F |
| InChI | InChI=1S/C13H10BrCl2FN2/c14-8-3-7(4-10(16)5-8)13(19-18)11-2-1-9(15)6-12(11)17/h1-6,13,19H,18H2 |
| InChIKey | RCFGGMDMBNYEDR-UHFFFAOYSA-N |
| XLogP | 4.45 |
| TPSA | 38.05 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 364.05 |
| LogP ≤ 5 | 4.45 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'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 [(3-bromo-5-chlorophenyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine?
The IUPAC name of [(3-bromo-5-chlorophenyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine (CID 107948431) is [(3-bromo-5-chlorophenyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine.
What is the SMILES notation for [(3-bromo-5-chlorophenyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine?
The canonical SMILES for [(3-bromo-5-chlorophenyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine is NNC(c1cc(Cl)cc(Br)c1)c1ccc(Cl)cc1F.
What is the InChIKey of [(3-bromo-5-chlorophenyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine?
The InChIKey is RCFGGMDMBNYEDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10BrCl2FN2/c14-8-3-7(4-10(16)5-8)13(19-18)11-2-1-9(15)6-12(11)17/h1-6,13,19H,18H2.
What are the key properties of [(3-bromo-5-chlorophenyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine?
[(3-bromo-5-chlorophenyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine has a molecular weight of 364.05 g/mol, XLogP of 4.45, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-bromo-5-chlorophenyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine is sourced from PubChem (CID 107948431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).