About 2-[(4-chlorophenyl)methoxy]oxolane
2-[(4-chlorophenyl)methoxy]oxolane (PubChem CID 102105550) has the molecular formula C11H13ClO2
and a molecular weight of 212.68 g/mol. Its IUPAC name is 2-[(4-chlorophenyl)methoxy]oxolane.
Molecular Properties
| Compound Name | 2-[(4-chlorophenyl)methoxy]oxolane |
| PubChem CID | 102105550 |
| Molecular Formula | C11H13ClO2 |
| Molecular Weight | 212.68 g/mol |
| Exact Mass | 212.06 |
| IUPAC Name | 2-[(4-chlorophenyl)methoxy]oxolane |
| SMILES | Clc1ccc(COC2CCCO2)cc1 |
| InChI | InChI=1S/C11H13ClO2/c12-10-5-3-9(4-6-10)8-14-11-2-1-7-13-11/h3-6,11H,1-2,7-8H2 |
| InChIKey | JZIKDDQYZOVWLJ-UHFFFAOYSA-N |
| XLogP | 2.99 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 212.68 |
| LogP ≤ 5 | 2.99 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-[(4-chlorophenyl)methoxy]oxolane?
The IUPAC name of 2-[(4-chlorophenyl)methoxy]oxolane (CID 102105550) is 2-[(4-chlorophenyl)methoxy]oxolane.
What is the SMILES notation for 2-[(4-chlorophenyl)methoxy]oxolane?
The canonical SMILES for 2-[(4-chlorophenyl)methoxy]oxolane is Clc1ccc(COC2CCCO2)cc1.
What is the InChIKey of 2-[(4-chlorophenyl)methoxy]oxolane?
The InChIKey is JZIKDDQYZOVWLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClO2/c12-10-5-3-9(4-6-10)8-14-11-2-1-7-13-11/h3-6,11H,1-2,7-8H2.
What are the key properties of 2-[(4-chlorophenyl)methoxy]oxolane?
2-[(4-chlorophenyl)methoxy]oxolane has a molecular weight of 212.68 g/mol, XLogP of 2.99, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chlorophenyl)methoxy]oxolane is sourced from PubChem (CID 102105550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).