About (Z)-5-methyl-4-propylhept-3-ene
(Z)-5-methyl-4-propylhept-3-ene (PubChem CID 145358469) has the molecular formula C11H22
and a molecular weight of 154.30 g/mol. Its IUPAC name is (Z)-5-methyl-4-propylhept-3-ene.
Molecular Properties
| Compound Name | (Z)-5-methyl-4-propylhept-3-ene |
| PubChem CID | 145358469 |
| Molecular Formula | C11H22 |
| Molecular Weight | 154.30 g/mol |
| Exact Mass | 154.17 |
| IUPAC Name | (Z)-5-methyl-4-propylhept-3-ene |
| SMILES | CC/C=C(/CCC)C(C)CC |
| InChI | InChI=1S/C11H22/c1-5-8-11(9-6-2)10(4)7-3/h8,10H,5-7,9H2,1-4H3/b11-8- |
| InChIKey | IRDHWXXUPJXNRB-FLIBITNWSA-N |
| XLogP | 4.17 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 5 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 154.30 |
| LogP ≤ 5 | 4.17 |
| 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 (Z)-5-methyl-4-propylhept-3-ene?
The IUPAC name of (Z)-5-methyl-4-propylhept-3-ene (CID 145358469) is (Z)-5-methyl-4-propylhept-3-ene.
What is the SMILES notation for (Z)-5-methyl-4-propylhept-3-ene?
The canonical SMILES for (Z)-5-methyl-4-propylhept-3-ene is CC/C=C(/CCC)C(C)CC.
What is the InChIKey of (Z)-5-methyl-4-propylhept-3-ene?
The InChIKey is IRDHWXXUPJXNRB-FLIBITNWSA-N. The full InChI is InChI=1S/C11H22/c1-5-8-11(9-6-2)10(4)7-3/h8,10H,5-7,9H2,1-4H3/b11-8-.
What are the key properties of (Z)-5-methyl-4-propylhept-3-ene?
(Z)-5-methyl-4-propylhept-3-ene has a molecular weight of 154.30 g/mol, XLogP of 4.17, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-methyl-4-propylhept-3-ene is sourced from PubChem (CID 145358469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).