About 1-methoxy-2-[1-[1-(2-methoxyphenyl)ethenoxy]ethenyl]benzene
1-methoxy-2-[1-[1-(2-methoxyphenyl)ethenoxy]ethenyl]benzene (PubChem CID 69260601) has the molecular formula C18H18O3
and a molecular weight of 282.34 g/mol. Its IUPAC name is 1-methoxy-2-[1-[1-(2-methoxyphenyl)ethenoxy]ethenyl]benzene.
Molecular Properties
| Compound Name | 1-methoxy-2-[1-[1-(2-methoxyphenyl)ethenoxy]ethenyl]benzene |
| PubChem CID | 69260601 |
| Molecular Formula | C18H18O3 |
| Molecular Weight | 282.34 g/mol |
| Exact Mass | 282.13 |
| IUPAC Name | 1-methoxy-2-[1-[1-(2-methoxyphenyl)ethenoxy]ethenyl]benzene |
| SMILES | C=C(OC(=C)c1ccccc1OC)c1ccccc1OC |
| InChI | InChI=1S/C18H18O3/c1-13(15-9-5-7-11-17(15)19-3)21-14(2)16-10-6-8-12-18(16)20-4/h5-12H,1-2H2,3-4H3 |
| InChIKey | BEVXJGUEBMQAII-UHFFFAOYSA-N |
| XLogP | 4.36 |
| TPSA | 27.69 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 282.34 |
| LogP ≤ 5 | 4.36 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'} |
|---|
Analyze 1-methoxy-2-[1-[1-(2-methoxyphenyl)ethenoxy]ethenyl]benzene with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of 1-methoxy-2-[1-[1-(2-methoxyphenyl)ethenoxy]ethenyl]benzene?
The IUPAC name of 1-methoxy-2-[1-[1-(2-methoxyphenyl)ethenoxy]ethenyl]benzene (CID 69260601) is 1-methoxy-2-[1-[1-(2-methoxyphenyl)ethenoxy]ethenyl]benzene.
What is the SMILES notation for 1-methoxy-2-[1-[1-(2-methoxyphenyl)ethenoxy]ethenyl]benzene?
The canonical SMILES for 1-methoxy-2-[1-[1-(2-methoxyphenyl)ethenoxy]ethenyl]benzene is C=C(OC(=C)c1ccccc1OC)c1ccccc1OC.
What is the InChIKey of 1-methoxy-2-[1-[1-(2-methoxyphenyl)ethenoxy]ethenyl]benzene?
The InChIKey is BEVXJGUEBMQAII-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18O3/c1-13(15-9-5-7-11-17(15)19-3)21-14(2)16-10-6-8-12-18(16)20-4/h5-12H,1-2H2,3-4H3.
What are the key properties of 1-methoxy-2-[1-[1-(2-methoxyphenyl)ethenoxy]ethenyl]benzene?
1-methoxy-2-[1-[1-(2-methoxyphenyl)ethenoxy]ethenyl]benzene has a molecular weight of 282.34 g/mol, XLogP of 4.36, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-[1-[1-(2-methoxyphenyl)ethenoxy]ethenyl]benzene is sourced from PubChem (CID 69260601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).