About 2-hydroxy-3-phenylbenzoic acid
2-hydroxy-3-phenylbenzoic acid (PubChem CID 9348) has the molecular formula C13H10O3
and a molecular weight of 214.22 g/mol. Its IUPAC name is 2-hydroxy-3-phenylbenzoic acid.
Molecular Properties
| Compound Name | 2-hydroxy-3-phenylbenzoic acid |
| PubChem CID | 9348 |
| Molecular Formula | C13H10O3 |
| Molecular Weight | 214.22 g/mol |
| Exact Mass | 214.06 |
| IUPAC Name | 2-hydroxy-3-phenylbenzoic acid |
| SMILES | O=C(O)c1cccc(-c2ccccc2)c1O |
| InChI | InChI=1S/C13H10O3/c14-12-10(9-5-2-1-3-6-9)7-4-8-11(12)13(15)16/h1-8,14H,(H,15,16) |
| InChIKey | ZJWUEJOPKFYFQD-UHFFFAOYSA-N |
| XLogP | 2.76 |
| TPSA | 57.53 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 214.22 |
| LogP ≤ 5 | 2.76 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-hydroxy-3-phenylbenzoic acid?
The IUPAC name of 2-hydroxy-3-phenylbenzoic acid (CID 9348) is 2-hydroxy-3-phenylbenzoic acid.
What is the SMILES notation for 2-hydroxy-3-phenylbenzoic acid?
The canonical SMILES for 2-hydroxy-3-phenylbenzoic acid is O=C(O)c1cccc(-c2ccccc2)c1O.
What is the InChIKey of 2-hydroxy-3-phenylbenzoic acid?
The InChIKey is ZJWUEJOPKFYFQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10O3/c14-12-10(9-5-2-1-3-6-9)7-4-8-11(12)13(15)16/h1-8,14H,(H,15,16).
What are the key properties of 2-hydroxy-3-phenylbenzoic acid?
2-hydroxy-3-phenylbenzoic acid has a molecular weight of 214.22 g/mol, XLogP of 2.76, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-phenylbenzoic acid is sourced from PubChem (CID 9348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).