About 2-chloro-N-(3-chlorophenyl)-N-hydroxybenzamide
2-chloro-N-(3-chlorophenyl)-N-hydroxybenzamide (PubChem CID 13173966) has the molecular formula C13H9Cl2NO2
and a molecular weight of 282.13 g/mol. Its IUPAC name is 2-chloro-N-(3-chlorophenyl)-N-hydroxybenzamide.
Molecular Properties
| Compound Name | 2-chloro-N-(3-chlorophenyl)-N-hydroxybenzamide |
| PubChem CID | 13173966 |
| Molecular Formula | C13H9Cl2NO2 |
| Molecular Weight | 282.13 g/mol |
| Exact Mass | 281.00 |
| IUPAC Name | 2-chloro-N-(3-chlorophenyl)-N-hydroxybenzamide |
| SMILES | O=C(c1ccccc1Cl)N(O)c1cccc(Cl)c1 |
| InChI | InChI=1S/C13H9Cl2NO2/c14-9-4-3-5-10(8-9)16(18)13(17)11-6-1-2-7-12(11)15/h1-8,18H |
| InChIKey | RQQOZDYJVHJQLN-UHFFFAOYSA-N |
| XLogP | 4.03 |
| TPSA | 40.54 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 282.13 |
| LogP ≤ 5 | 4.03 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydroxamic_acid', '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-chloro-N-(3-chlorophenyl)-N-hydroxybenzamide?
The IUPAC name of 2-chloro-N-(3-chlorophenyl)-N-hydroxybenzamide (CID 13173966) is 2-chloro-N-(3-chlorophenyl)-N-hydroxybenzamide.
What is the SMILES notation for 2-chloro-N-(3-chlorophenyl)-N-hydroxybenzamide?
The canonical SMILES for 2-chloro-N-(3-chlorophenyl)-N-hydroxybenzamide is O=C(c1ccccc1Cl)N(O)c1cccc(Cl)c1.
What is the InChIKey of 2-chloro-N-(3-chlorophenyl)-N-hydroxybenzamide?
The InChIKey is RQQOZDYJVHJQLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9Cl2NO2/c14-9-4-3-5-10(8-9)16(18)13(17)11-6-1-2-7-12(11)15/h1-8,18H.
What are the key properties of 2-chloro-N-(3-chlorophenyl)-N-hydroxybenzamide?
2-chloro-N-(3-chlorophenyl)-N-hydroxybenzamide has a molecular weight of 282.13 g/mol, XLogP of 4.03, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(3-chlorophenyl)-N-hydroxybenzamide is sourced from PubChem (CID 13173966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).