About [2-(2-methoxyethoxy)phenyl]-diphenylselanium
[2-(2-methoxyethoxy)phenyl]-diphenylselanium (PubChem CID 139829681) has the molecular formula C21H21O2Se+
and a molecular weight of 384.36 g/mol. Its IUPAC name is [2-(2-methoxyethoxy)phenyl]-diphenylselanium.
Molecular Properties
| Compound Name | [2-(2-methoxyethoxy)phenyl]-diphenylselanium |
| PubChem CID | 139829681 |
| Molecular Formula | C21H21O2Se+ |
| Molecular Weight | 384.36 g/mol |
| Exact Mass | 385.07 |
| IUPAC Name | [2-(2-methoxyethoxy)phenyl]-diphenylselanium |
| SMILES | COCCOc1ccccc1[Se+](c1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C21H21O2Se/c1-22-16-17-23-20-14-8-9-15-21(20)24(18-10-4-2-5-11-18)19-12-6-3-7-13-19/h2-15H,16-17H2,1H3/q+1 |
| InChIKey | DDQIXPHLUZTGFI-UHFFFAOYSA-N |
| XLogP | 2.23 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 384.36 |
| LogP ≤ 5 | 2.23 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of [2-(2-methoxyethoxy)phenyl]-diphenylselanium?
The IUPAC name of [2-(2-methoxyethoxy)phenyl]-diphenylselanium (CID 139829681) is [2-(2-methoxyethoxy)phenyl]-diphenylselanium.
What is the SMILES notation for [2-(2-methoxyethoxy)phenyl]-diphenylselanium?
The canonical SMILES for [2-(2-methoxyethoxy)phenyl]-diphenylselanium is COCCOc1ccccc1[Se+](c1ccccc1)c1ccccc1.
What is the InChIKey of [2-(2-methoxyethoxy)phenyl]-diphenylselanium?
The InChIKey is DDQIXPHLUZTGFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21O2Se/c1-22-16-17-23-20-14-8-9-15-21(20)24(18-10-4-2-5-11-18)19-12-6-3-7-13-19/h2-15H,16-17H2,1H3/q+1.
What are the key properties of [2-(2-methoxyethoxy)phenyl]-diphenylselanium?
[2-(2-methoxyethoxy)phenyl]-diphenylselanium has a molecular weight of 384.36 g/mol, XLogP of 2.23, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methoxyethoxy)phenyl]-diphenylselanium is sourced from PubChem (CID 139829681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).