About (E)-4-ethyltetradec-3-en-2-ol
(E)-4-ethyltetradec-3-en-2-ol (PubChem CID 101429656) has the molecular formula C16H32O
and a molecular weight of 240.43 g/mol. Its IUPAC name is (E)-4-ethyltetradec-3-en-2-ol.
Molecular Properties
| Compound Name | (E)-4-ethyltetradec-3-en-2-ol |
| PubChem CID | 101429656 |
| Molecular Formula | C16H32O |
| Molecular Weight | 240.43 g/mol |
| Exact Mass | 240.25 |
| IUPAC Name | (E)-4-ethyltetradec-3-en-2-ol |
| SMILES | CCCCCCCCCC/C(=C/C(C)O)CC |
| InChI | InChI=1S/C16H32O/c1-4-6-7-8-9-10-11-12-13-16(5-2)14-15(3)17/h14-15,17H,4-13H2,1-3H3/b16-14+ |
| InChIKey | FURADOYOECYXNV-JQIJEIRASA-N |
| XLogP | 5.23 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 11 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 240.43 |
| LogP ≤ 5 | 5.23 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of (E)-4-ethyltetradec-3-en-2-ol?
The IUPAC name of (E)-4-ethyltetradec-3-en-2-ol (CID 101429656) is (E)-4-ethyltetradec-3-en-2-ol.
What is the SMILES notation for (E)-4-ethyltetradec-3-en-2-ol?
The canonical SMILES for (E)-4-ethyltetradec-3-en-2-ol is CCCCCCCCCC/C(=C/C(C)O)CC.
What is the InChIKey of (E)-4-ethyltetradec-3-en-2-ol?
The InChIKey is FURADOYOECYXNV-JQIJEIRASA-N. The full InChI is InChI=1S/C16H32O/c1-4-6-7-8-9-10-11-12-13-16(5-2)14-15(3)17/h14-15,17H,4-13H2,1-3H3/b16-14+.
What are the key properties of (E)-4-ethyltetradec-3-en-2-ol?
(E)-4-ethyltetradec-3-en-2-ol has a molecular weight of 240.43 g/mol, XLogP of 5.23, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-ethyltetradec-3-en-2-ol is sourced from PubChem (CID 101429656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).