About [3-(2-chlorophenyl)-5-methoxyphenyl]methanol
[3-(2-chlorophenyl)-5-methoxyphenyl]methanol (PubChem CID 123183360) has the molecular formula C14H13ClO2
and a molecular weight of 248.71 g/mol. Its IUPAC name is [3-(2-chlorophenyl)-5-methoxyphenyl]methanol.
Molecular Properties
| Compound Name | [3-(2-chlorophenyl)-5-methoxyphenyl]methanol |
| PubChem CID | 123183360 |
| Molecular Formula | C14H13ClO2 |
| Molecular Weight | 248.71 g/mol |
| Exact Mass | 248.06 |
| IUPAC Name | [3-(2-chlorophenyl)-5-methoxyphenyl]methanol |
| SMILES | COc1cc(CO)cc(-c2ccccc2Cl)c1 |
| InChI | InChI=1S/C14H13ClO2/c1-17-12-7-10(9-16)6-11(8-12)13-4-2-3-5-14(13)15/h2-8,16H,9H2,1H3 |
| InChIKey | IFIIYGYREIXDNN-UHFFFAOYSA-N |
| XLogP | 3.51 |
| TPSA | 29.46 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 248.71 |
| LogP ≤ 5 | 3.51 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of [3-(2-chlorophenyl)-5-methoxyphenyl]methanol?
The IUPAC name of [3-(2-chlorophenyl)-5-methoxyphenyl]methanol (CID 123183360) is [3-(2-chlorophenyl)-5-methoxyphenyl]methanol.
What is the SMILES notation for [3-(2-chlorophenyl)-5-methoxyphenyl]methanol?
The canonical SMILES for [3-(2-chlorophenyl)-5-methoxyphenyl]methanol is COc1cc(CO)cc(-c2ccccc2Cl)c1.
What is the InChIKey of [3-(2-chlorophenyl)-5-methoxyphenyl]methanol?
The InChIKey is IFIIYGYREIXDNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClO2/c1-17-12-7-10(9-16)6-11(8-12)13-4-2-3-5-14(13)15/h2-8,16H,9H2,1H3.
What are the key properties of [3-(2-chlorophenyl)-5-methoxyphenyl]methanol?
[3-(2-chlorophenyl)-5-methoxyphenyl]methanol has a molecular weight of 248.71 g/mol, XLogP of 3.51, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-chlorophenyl)-5-methoxyphenyl]methanol is sourced from PubChem (CID 123183360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).