About [(2-bromo-5-chlorophenyl)-(3-chloro-4-methylphenyl)methyl]hydrazine
[(2-bromo-5-chlorophenyl)-(3-chloro-4-methylphenyl)methyl]hydrazine (PubChem CID 114027467) has the molecular formula C14H13BrCl2N2
and a molecular weight of 360.08 g/mol. Its IUPAC name is [(2-bromo-5-chlorophenyl)-(3-chloro-4-methylphenyl)methyl]hydrazine.
Molecular Properties
| Compound Name | [(2-bromo-5-chlorophenyl)-(3-chloro-4-methylphenyl)methyl]hydrazine |
| PubChem CID | 114027467 |
| Molecular Formula | C14H13BrCl2N2 |
| Molecular Weight | 360.08 g/mol |
| Exact Mass | 357.96 |
| IUPAC Name | [(2-bromo-5-chlorophenyl)-(3-chloro-4-methylphenyl)methyl]hydrazine |
| SMILES | Cc1ccc(C(NN)c2cc(Cl)ccc2Br)cc1Cl |
| InChI | InChI=1S/C14H13BrCl2N2/c1-8-2-3-9(6-13(8)17)14(19-18)11-7-10(16)4-5-12(11)15/h2-7,14,19H,18H2,1H3 |
| InChIKey | NOAQFSIHMCZJEH-UHFFFAOYSA-N |
| XLogP | 4.62 |
| 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 | 360.08 |
| LogP ≤ 5 | 4.62 |
| 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 [(2-bromo-5-chlorophenyl)-(3-chloro-4-methylphenyl)methyl]hydrazine?
The IUPAC name of [(2-bromo-5-chlorophenyl)-(3-chloro-4-methylphenyl)methyl]hydrazine (CID 114027467) is [(2-bromo-5-chlorophenyl)-(3-chloro-4-methylphenyl)methyl]hydrazine.
What is the SMILES notation for [(2-bromo-5-chlorophenyl)-(3-chloro-4-methylphenyl)methyl]hydrazine?
The canonical SMILES for [(2-bromo-5-chlorophenyl)-(3-chloro-4-methylphenyl)methyl]hydrazine is Cc1ccc(C(NN)c2cc(Cl)ccc2Br)cc1Cl.
What is the InChIKey of [(2-bromo-5-chlorophenyl)-(3-chloro-4-methylphenyl)methyl]hydrazine?
The InChIKey is NOAQFSIHMCZJEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrCl2N2/c1-8-2-3-9(6-13(8)17)14(19-18)11-7-10(16)4-5-12(11)15/h2-7,14,19H,18H2,1H3.
What are the key properties of [(2-bromo-5-chlorophenyl)-(3-chloro-4-methylphenyl)methyl]hydrazine?
[(2-bromo-5-chlorophenyl)-(3-chloro-4-methylphenyl)methyl]hydrazine has a molecular weight of 360.08 g/mol, XLogP of 4.62, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-bromo-5-chlorophenyl)-(3-chloro-4-methylphenyl)methyl]hydrazine is sourced from PubChem (CID 114027467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).