About 2-(2-methoxyphenyl)-2-phenylacetate
2-(2-methoxyphenyl)-2-phenylacetate (PubChem CID 57353343) has the molecular formula C15H13O3-
and a molecular weight of 241.27 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-2-phenylacetate.
Molecular Properties
| Compound Name | 2-(2-methoxyphenyl)-2-phenylacetate |
| PubChem CID | 57353343 |
| Molecular Formula | C15H13O3- |
| Molecular Weight | 241.27 g/mol |
| Exact Mass | 241.09 |
| IUPAC Name | 2-(2-methoxyphenyl)-2-phenylacetate |
| SMILES | COc1ccccc1C(C(=O)[O-])c1ccccc1 |
| InChI | InChI=1S/C15H14O3/c1-18-13-10-6-5-9-12(13)14(15(16)17)11-7-3-2-4-8-11/h2-10,14H,1H3,(H,16,17)/p-1 |
| InChIKey | CEIAQTSBIRBMGU-UHFFFAOYSA-M |
| XLogP | 1.58 |
| TPSA | 49.36 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 241.27 |
| LogP ≤ 5 | 1.58 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-(2-methoxyphenyl)-2-phenylacetate?
The IUPAC name of 2-(2-methoxyphenyl)-2-phenylacetate (CID 57353343) is 2-(2-methoxyphenyl)-2-phenylacetate.
What is the SMILES notation for 2-(2-methoxyphenyl)-2-phenylacetate?
The canonical SMILES for 2-(2-methoxyphenyl)-2-phenylacetate is COc1ccccc1C(C(=O)[O-])c1ccccc1.
What is the InChIKey of 2-(2-methoxyphenyl)-2-phenylacetate?
The InChIKey is CEIAQTSBIRBMGU-UHFFFAOYSA-M. The full InChI is InChI=1S/C15H14O3/c1-18-13-10-6-5-9-12(13)14(15(16)17)11-7-3-2-4-8-11/h2-10,14H,1H3,(H,16,17)/p-1.
What are the key properties of 2-(2-methoxyphenyl)-2-phenylacetate?
2-(2-methoxyphenyl)-2-phenylacetate has a molecular weight of 241.27 g/mol, XLogP of 1.58, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-2-phenylacetate is sourced from PubChem (CID 57353343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).