About 3-(4-hydroxyphenyl)phenol;propane
3-(4-hydroxyphenyl)phenol;propane (PubChem CID 175032185) has the molecular formula C15H18O2
and a molecular weight of 230.31 g/mol. Its IUPAC name is 3-(4-hydroxyphenyl)phenol;propane.
Molecular Properties
| Compound Name | 3-(4-hydroxyphenyl)phenol;propane |
| PubChem CID | 175032185 |
| Molecular Formula | C15H18O2 |
| Molecular Weight | 230.31 g/mol |
| Exact Mass | 230.13 |
| IUPAC Name | 3-(4-hydroxyphenyl)phenol;propane |
| SMILES | CCC.Oc1ccc(-c2cccc(O)c2)cc1 |
| InChI | InChI=1S/C12H10O2.C3H8/c13-11-6-4-9(5-7-11)10-2-1-3-12(14)8-10;1-3-2/h1-8,13-14H;3H2,1-2H3 |
| InChIKey | YHXPOLDAFIWGSD-UHFFFAOYSA-N |
| XLogP | 4.18 |
| TPSA | 40.46 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 230.31 |
| LogP ≤ 5 | 4.18 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 3-(4-hydroxyphenyl)phenol;propane?
The IUPAC name of 3-(4-hydroxyphenyl)phenol;propane (CID 175032185) is 3-(4-hydroxyphenyl)phenol;propane.
What is the SMILES notation for 3-(4-hydroxyphenyl)phenol;propane?
The canonical SMILES for 3-(4-hydroxyphenyl)phenol;propane is CCC.Oc1ccc(-c2cccc(O)c2)cc1.
What is the InChIKey of 3-(4-hydroxyphenyl)phenol;propane?
The InChIKey is YHXPOLDAFIWGSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10O2.C3H8/c13-11-6-4-9(5-7-11)10-2-1-3-12(14)8-10;1-3-2/h1-8,13-14H;3H2,1-2H3.
What are the key properties of 3-(4-hydroxyphenyl)phenol;propane?
3-(4-hydroxyphenyl)phenol;propane has a molecular weight of 230.31 g/mol, XLogP of 4.18, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-hydroxyphenyl)phenol;propane is sourced from PubChem (CID 175032185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).