About [(4-chloro-2-fluorophenyl)-(4-chloro-2-methylphenyl)methyl]hydrazine
[(4-chloro-2-fluorophenyl)-(4-chloro-2-methylphenyl)methyl]hydrazine (PubChem CID 114028440) has the molecular formula C14H13Cl2FN2
and a molecular weight of 299.18 g/mol. Its IUPAC name is [(4-chloro-2-fluorophenyl)-(4-chloro-2-methylphenyl)methyl]hydrazine.
Molecular Properties
| Compound Name | [(4-chloro-2-fluorophenyl)-(4-chloro-2-methylphenyl)methyl]hydrazine |
| PubChem CID | 114028440 |
| Molecular Formula | C14H13Cl2FN2 |
| Molecular Weight | 299.18 g/mol |
| Exact Mass | 298.04 |
| IUPAC Name | [(4-chloro-2-fluorophenyl)-(4-chloro-2-methylphenyl)methyl]hydrazine |
| SMILES | Cc1cc(Cl)ccc1C(NN)c1ccc(Cl)cc1F |
| InChI | InChI=1S/C14H13Cl2FN2/c1-8-6-9(15)2-4-11(8)14(19-18)12-5-3-10(16)7-13(12)17/h2-7,14,19H,18H2,1H3 |
| InChIKey | ASKVTBSCAOHDDW-UHFFFAOYSA-N |
| XLogP | 3.99 |
| 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 | 299.18 |
| LogP ≤ 5 | 3.99 |
| 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'} |
|---|
Analyze [(4-chloro-2-fluorophenyl)-(4-chloro-2-methylphenyl)methyl]hydrazine with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of [(4-chloro-2-fluorophenyl)-(4-chloro-2-methylphenyl)methyl]hydrazine?
The IUPAC name of [(4-chloro-2-fluorophenyl)-(4-chloro-2-methylphenyl)methyl]hydrazine (CID 114028440) is [(4-chloro-2-fluorophenyl)-(4-chloro-2-methylphenyl)methyl]hydrazine.
What is the SMILES notation for [(4-chloro-2-fluorophenyl)-(4-chloro-2-methylphenyl)methyl]hydrazine?
The canonical SMILES for [(4-chloro-2-fluorophenyl)-(4-chloro-2-methylphenyl)methyl]hydrazine is Cc1cc(Cl)ccc1C(NN)c1ccc(Cl)cc1F.
What is the InChIKey of [(4-chloro-2-fluorophenyl)-(4-chloro-2-methylphenyl)methyl]hydrazine?
The InChIKey is ASKVTBSCAOHDDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2FN2/c1-8-6-9(15)2-4-11(8)14(19-18)12-5-3-10(16)7-13(12)17/h2-7,14,19H,18H2,1H3.
What are the key properties of [(4-chloro-2-fluorophenyl)-(4-chloro-2-methylphenyl)methyl]hydrazine?
[(4-chloro-2-fluorophenyl)-(4-chloro-2-methylphenyl)methyl]hydrazine has a molecular weight of 299.18 g/mol, XLogP of 3.99, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-chloro-2-fluorophenyl)-(4-chloro-2-methylphenyl)methyl]hydrazine is sourced from PubChem (CID 114028440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).