About 1-(3-methylphenyl)ethenylhydrazine
1-(3-methylphenyl)ethenylhydrazine (PubChem CID 129060271) has the molecular formula C9H12N2
and a molecular weight of 148.21 g/mol. Its IUPAC name is 1-(3-methylphenyl)ethenylhydrazine.
Molecular Properties
| Compound Name | 1-(3-methylphenyl)ethenylhydrazine |
| PubChem CID | 129060271 |
| Molecular Formula | C9H12N2 |
| Molecular Weight | 148.21 g/mol |
| Exact Mass | 148.10 |
| IUPAC Name | 1-(3-methylphenyl)ethenylhydrazine |
| SMILES | C=C(NN)c1cccc(C)c1 |
| InChI | InChI=1S/C9H12N2/c1-7-4-3-5-9(6-7)8(2)11-10/h3-6,11H,2,10H2,1H3 |
| InChIKey | CJRBDCGCPBSVHH-UHFFFAOYSA-N |
| XLogP | 1.43 |
| 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 | 148.21 |
| LogP ≤ 5 | 1.43 |
| 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 1-(3-methylphenyl)ethenylhydrazine?
The IUPAC name of 1-(3-methylphenyl)ethenylhydrazine (CID 129060271) is 1-(3-methylphenyl)ethenylhydrazine.
What is the SMILES notation for 1-(3-methylphenyl)ethenylhydrazine?
The canonical SMILES for 1-(3-methylphenyl)ethenylhydrazine is C=C(NN)c1cccc(C)c1.
What is the InChIKey of 1-(3-methylphenyl)ethenylhydrazine?
The InChIKey is CJRBDCGCPBSVHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2/c1-7-4-3-5-9(6-7)8(2)11-10/h3-6,11H,2,10H2,1H3.
What are the key properties of 1-(3-methylphenyl)ethenylhydrazine?
1-(3-methylphenyl)ethenylhydrazine has a molecular weight of 148.21 g/mol, XLogP of 1.43, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylphenyl)ethenylhydrazine is sourced from PubChem (CID 129060271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).