About (2-methyl-5-nitrophenyl)hydrazine
(2-methyl-5-nitrophenyl)hydrazine (PubChem CID 3918674) has the molecular formula C7H9N3O2
and a molecular weight of 167.17 g/mol. Its IUPAC name is (2-methyl-5-nitrophenyl)hydrazine.
Molecular Properties
| Compound Name | (2-methyl-5-nitrophenyl)hydrazine |
| PubChem CID | 3918674 |
| Molecular Formula | C7H9N3O2 |
| Molecular Weight | 167.17 g/mol |
| Exact Mass | 167.07 |
| IUPAC Name | (2-methyl-5-nitrophenyl)hydrazine |
| SMILES | Cc1ccc([N+](=O)[O-])cc1NN |
| InChI | InChI=1S/C7H9N3O2/c1-5-2-3-6(10(11)12)4-7(5)9-8/h2-4,9H,8H2,1H3 |
| InChIKey | ZMHHLAAPJJAADE-UHFFFAOYSA-N |
| XLogP | 1.19 |
| TPSA | 81.19 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 167.17 |
| LogP ≤ 5 | 1.19 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', '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-methyl-5-nitrophenyl)hydrazine?
The IUPAC name of (2-methyl-5-nitrophenyl)hydrazine (CID 3918674) is (2-methyl-5-nitrophenyl)hydrazine.
What is the SMILES notation for (2-methyl-5-nitrophenyl)hydrazine?
The canonical SMILES for (2-methyl-5-nitrophenyl)hydrazine is Cc1ccc([N+](=O)[O-])cc1NN.
What is the InChIKey of (2-methyl-5-nitrophenyl)hydrazine?
The InChIKey is ZMHHLAAPJJAADE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O2/c1-5-2-3-6(10(11)12)4-7(5)9-8/h2-4,9H,8H2,1H3.
What are the key properties of (2-methyl-5-nitrophenyl)hydrazine?
(2-methyl-5-nitrophenyl)hydrazine has a molecular weight of 167.17 g/mol, XLogP of 1.19, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-5-nitrophenyl)hydrazine is sourced from PubChem (CID 3918674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).