About (1E)-1-methoxycyclotridecene
(1E)-1-methoxycyclotridecene (PubChem CID 5463530) has the molecular formula C14H26O
and a molecular weight of 210.36 g/mol. Its IUPAC name is (1E)-1-methoxycyclotridecene.
Molecular Properties
| Compound Name | (1E)-1-methoxycyclotridecene |
| PubChem CID | 5463530 |
| Molecular Formula | C14H26O |
| Molecular Weight | 210.36 g/mol |
| Exact Mass | 210.20 |
| IUPAC Name | (1E)-1-methoxycyclotridecene |
| SMILES | CO/C1=C/CCCCCCCCCCC1 |
| InChI | InChI=1S/C14H26O/c1-15-14-12-10-8-6-4-2-3-5-7-9-11-13-14/h12H,2-11,13H2,1H3/b14-12+ |
| InChIKey | DQNSWVPJRZTUNF-WYMLVPIESA-N |
| XLogP | 4.82 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 210.36 |
| LogP ≤ 5 | 4.82 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of (1E)-1-methoxycyclotridecene?
The IUPAC name of (1E)-1-methoxycyclotridecene (CID 5463530) is (1E)-1-methoxycyclotridecene.
What is the SMILES notation for (1E)-1-methoxycyclotridecene?
The canonical SMILES for (1E)-1-methoxycyclotridecene is CO/C1=C/CCCCCCCCCCC1.
What is the InChIKey of (1E)-1-methoxycyclotridecene?
The InChIKey is DQNSWVPJRZTUNF-WYMLVPIESA-N. The full InChI is InChI=1S/C14H26O/c1-15-14-12-10-8-6-4-2-3-5-7-9-11-13-14/h12H,2-11,13H2,1H3/b14-12+.
What are the key properties of (1E)-1-methoxycyclotridecene?
(1E)-1-methoxycyclotridecene has a molecular weight of 210.36 g/mol, XLogP of 4.82, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1E)-1-methoxycyclotridecene is sourced from PubChem (CID 5463530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).