About bis(pent-1-ene);pent-2-ene
bis(pent-1-ene);pent-2-ene (PubChem CID 158608078) has the molecular formula C15H30
and a molecular weight of 210.40 g/mol. Its IUPAC name is bis(pent-1-ene);pent-2-ene.
Molecular Properties
| Compound Name | bis(pent-1-ene);pent-2-ene |
| PubChem CID | 158608078 |
| Molecular Formula | C15H30 |
| Molecular Weight | 210.40 g/mol |
| Exact Mass | 210.23 |
| IUPAC Name | bis(pent-1-ene);pent-2-ene |
| SMILES | C=CCCC.C=CCCC.CC=CCC |
| InChI | InChI=1S/3C5H10/c3*1-3-5-4-2/h3,5H,4H2,1-2H3;2*3H,1,4-5H2,2H3 |
| InChIKey | HWMGLEJBHPLZHV-UHFFFAOYSA-N |
| XLogP | 5.92 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 5 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 210.40 |
| LogP ≤ 5 | 5.92 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of bis(pent-1-ene);pent-2-ene?
The IUPAC name of bis(pent-1-ene);pent-2-ene (CID 158608078) is bis(pent-1-ene);pent-2-ene.
What is the SMILES notation for bis(pent-1-ene);pent-2-ene?
The canonical SMILES for bis(pent-1-ene);pent-2-ene is C=CCCC.C=CCCC.CC=CCC.
What is the InChIKey of bis(pent-1-ene);pent-2-ene?
The InChIKey is HWMGLEJBHPLZHV-UHFFFAOYSA-N. The full InChI is InChI=1S/3C5H10/c3*1-3-5-4-2/h3,5H,4H2,1-2H3;2*3H,1,4-5H2,2H3.
What are the key properties of bis(pent-1-ene);pent-2-ene?
bis(pent-1-ene);pent-2-ene has a molecular weight of 210.40 g/mol, XLogP of 5.92, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(pent-1-ene);pent-2-ene is sourced from PubChem (CID 158608078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).