About bis(3-ethenylphenyl)diazene
bis(3-ethenylphenyl)diazene (PubChem CID 102247912) has the molecular formula C16H14N2
and a molecular weight of 234.30 g/mol. Its IUPAC name is bis(3-ethenylphenyl)diazene.
Molecular Properties
| Compound Name | bis(3-ethenylphenyl)diazene |
| PubChem CID | 102247912 |
| Molecular Formula | C16H14N2 |
| Molecular Weight | 234.30 g/mol |
| Exact Mass | 234.12 |
| IUPAC Name | bis(3-ethenylphenyl)diazene |
| SMILES | C=Cc1cccc(/N=N/c2cccc(C=C)c2)c1 |
| InChI | InChI=1S/C16H14N2/c1-3-13-7-5-9-15(11-13)17-18-16-10-6-8-14(4-2)12-16/h3-12H,1-2H2/b18-17+ |
| InChIKey | RYFAXGBTNKIVKL-ISLYRVAYSA-N |
| XLogP | 5.39 |
| TPSA | 24.72 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 234.30 |
| LogP ≤ 5 | 5.39 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of bis(3-ethenylphenyl)diazene?
The IUPAC name of bis(3-ethenylphenyl)diazene (CID 102247912) is bis(3-ethenylphenyl)diazene.
What is the SMILES notation for bis(3-ethenylphenyl)diazene?
The canonical SMILES for bis(3-ethenylphenyl)diazene is C=Cc1cccc(/N=N/c2cccc(C=C)c2)c1.
What is the InChIKey of bis(3-ethenylphenyl)diazene?
The InChIKey is RYFAXGBTNKIVKL-ISLYRVAYSA-N. The full InChI is InChI=1S/C16H14N2/c1-3-13-7-5-9-15(11-13)17-18-16-10-6-8-14(4-2)12-16/h3-12H,1-2H2/b18-17+.
What are the key properties of bis(3-ethenylphenyl)diazene?
bis(3-ethenylphenyl)diazene has a molecular weight of 234.30 g/mol, XLogP of 5.39, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(3-ethenylphenyl)diazene is sourced from PubChem (CID 102247912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).