About (3-chloro-2-ethylphenyl)hydrazine
(3-chloro-2-ethylphenyl)hydrazine (PubChem CID 67877946) has the molecular formula C8H11ClN2
and a molecular weight of 170.64 g/mol. Its IUPAC name is (3-chloro-2-ethylphenyl)hydrazine.
Molecular Properties
| Compound Name | (3-chloro-2-ethylphenyl)hydrazine |
| PubChem CID | 67877946 |
| Molecular Formula | C8H11ClN2 |
| Molecular Weight | 170.64 g/mol |
| Exact Mass | 170.06 |
| IUPAC Name | (3-chloro-2-ethylphenyl)hydrazine |
| SMILES | CCc1c(Cl)cccc1NN |
| InChI | InChI=1S/C8H11ClN2/c1-2-6-7(9)4-3-5-8(6)11-10/h3-5,11H,2,10H2,1H3 |
| InChIKey | NFQNYSIOTVHAFB-UHFFFAOYSA-N |
| XLogP | 2.19 |
| TPSA | 38.05 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 170.64 |
| LogP ≤ 5 | 2.19 |
| 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 (3-chloro-2-ethylphenyl)hydrazine?
The IUPAC name of (3-chloro-2-ethylphenyl)hydrazine (CID 67877946) is (3-chloro-2-ethylphenyl)hydrazine.
What is the SMILES notation for (3-chloro-2-ethylphenyl)hydrazine?
The canonical SMILES for (3-chloro-2-ethylphenyl)hydrazine is CCc1c(Cl)cccc1NN.
What is the InChIKey of (3-chloro-2-ethylphenyl)hydrazine?
The InChIKey is NFQNYSIOTVHAFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11ClN2/c1-2-6-7(9)4-3-5-8(6)11-10/h3-5,11H,2,10H2,1H3.
What are the key properties of (3-chloro-2-ethylphenyl)hydrazine?
(3-chloro-2-ethylphenyl)hydrazine has a molecular weight of 170.64 g/mol, XLogP of 2.19, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-2-ethylphenyl)hydrazine is sourced from PubChem (CID 67877946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).