About (4-methylnaphthalen-1-yl)-diphenylmethanol
(4-methylnaphthalen-1-yl)-diphenylmethanol (PubChem CID 2817969) has the molecular formula C24H20O
and a molecular weight of 324.42 g/mol. Its IUPAC name is (4-methylnaphthalen-1-yl)-diphenylmethanol.
Molecular Properties
| Compound Name | (4-methylnaphthalen-1-yl)-diphenylmethanol |
| PubChem CID | 2817969 |
| Molecular Formula | C24H20O |
| Molecular Weight | 324.42 g/mol |
| Exact Mass | 324.15 |
| IUPAC Name | (4-methylnaphthalen-1-yl)-diphenylmethanol |
| SMILES | Cc1ccc(C(O)(c2ccccc2)c2ccccc2)c2ccccc12 |
| InChI | InChI=1S/C24H20O/c1-18-16-17-23(22-15-9-8-14-21(18)22)24(25,19-10-4-2-5-11-19)20-12-6-3-7-13-20/h2-17,25H,1H3 |
| InChIKey | WBNIZGNJORQFLR-UHFFFAOYSA-N |
| XLogP | 5.43 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 25 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 324.42 |
| LogP ≤ 5 | 5.43 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of (4-methylnaphthalen-1-yl)-diphenylmethanol?
The IUPAC name of (4-methylnaphthalen-1-yl)-diphenylmethanol (CID 2817969) is (4-methylnaphthalen-1-yl)-diphenylmethanol.
What is the SMILES notation for (4-methylnaphthalen-1-yl)-diphenylmethanol?
The canonical SMILES for (4-methylnaphthalen-1-yl)-diphenylmethanol is Cc1ccc(C(O)(c2ccccc2)c2ccccc2)c2ccccc12.
What is the InChIKey of (4-methylnaphthalen-1-yl)-diphenylmethanol?
The InChIKey is WBNIZGNJORQFLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20O/c1-18-16-17-23(22-15-9-8-14-21(18)22)24(25,19-10-4-2-5-11-19)20-12-6-3-7-13-20/h2-17,25H,1H3.
What are the key properties of (4-methylnaphthalen-1-yl)-diphenylmethanol?
(4-methylnaphthalen-1-yl)-diphenylmethanol has a molecular weight of 324.42 g/mol, XLogP of 5.43, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylnaphthalen-1-yl)-diphenylmethanol is sourced from PubChem (CID 2817969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).