About 5-[(Z)-[(2-chlorophenyl)hydrazinylidene]methyl]-2-methoxyphenol
5-[(Z)-[(2-chlorophenyl)hydrazinylidene]methyl]-2-methoxyphenol (PubChem CID 8002358) has the molecular formula C14H13ClN2O2
and a molecular weight of 276.72 g/mol. Its IUPAC name is 5-[(Z)-[(2-chlorophenyl)hydrazinylidene]methyl]-2-methoxyphenol.
Molecular Properties
| Compound Name | 5-[(Z)-[(2-chlorophenyl)hydrazinylidene]methyl]-2-methoxyphenol |
| PubChem CID | 8002358 |
| Molecular Formula | C14H13ClN2O2 |
| Molecular Weight | 276.72 g/mol |
| Exact Mass | 276.07 |
| IUPAC Name | 5-[(Z)-[(2-chlorophenyl)hydrazinylidene]methyl]-2-methoxyphenol |
| SMILES | COc1ccc(/C=N\Nc2ccccc2Cl)cc1O |
| InChI | InChI=1S/C14H13ClN2O2/c1-19-14-7-6-10(8-13(14)18)9-16-17-12-5-3-2-4-11(12)15/h2-9,17-18H,1H3/b16-9- |
| InChIKey | HMZSPCFEJFPVCD-SXGWCWSVSA-N |
| XLogP | 3.50 |
| TPSA | 53.85 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 276.72 |
| LogP ≤ 5 | 3.50 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', '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 5-[(Z)-[(2-chlorophenyl)hydrazinylidene]methyl]-2-methoxyphenol?
The IUPAC name of 5-[(Z)-[(2-chlorophenyl)hydrazinylidene]methyl]-2-methoxyphenol (CID 8002358) is 5-[(Z)-[(2-chlorophenyl)hydrazinylidene]methyl]-2-methoxyphenol.
What is the SMILES notation for 5-[(Z)-[(2-chlorophenyl)hydrazinylidene]methyl]-2-methoxyphenol?
The canonical SMILES for 5-[(Z)-[(2-chlorophenyl)hydrazinylidene]methyl]-2-methoxyphenol is COc1ccc(/C=N\Nc2ccccc2Cl)cc1O.
What is the InChIKey of 5-[(Z)-[(2-chlorophenyl)hydrazinylidene]methyl]-2-methoxyphenol?
The InChIKey is HMZSPCFEJFPVCD-SXGWCWSVSA-N. The full InChI is InChI=1S/C14H13ClN2O2/c1-19-14-7-6-10(8-13(14)18)9-16-17-12-5-3-2-4-11(12)15/h2-9,17-18H,1H3/b16-9-.
What are the key properties of 5-[(Z)-[(2-chlorophenyl)hydrazinylidene]methyl]-2-methoxyphenol?
5-[(Z)-[(2-chlorophenyl)hydrazinylidene]methyl]-2-methoxyphenol has a molecular weight of 276.72 g/mol, XLogP of 3.50, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(Z)-[(2-chlorophenyl)hydrazinylidene]methyl]-2-methoxyphenol is sourced from PubChem (CID 8002358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).