About 6-fluoro-4-methyl-2,3-dihydro-1H-inden-1-ol
6-fluoro-4-methyl-2,3-dihydro-1H-inden-1-ol (PubChem CID 62124897) has the molecular formula C10H11FO
and a molecular weight of 166.19 g/mol. Its IUPAC name is 6-fluoro-4-methyl-2,3-dihydro-1H-inden-1-ol.
Molecular Properties
| Compound Name | 6-fluoro-4-methyl-2,3-dihydro-1H-inden-1-ol |
| PubChem CID | 62124897 |
| Molecular Formula | C10H11FO |
| Molecular Weight | 166.19 g/mol |
| Exact Mass | 166.08 |
| IUPAC Name | 6-fluoro-4-methyl-2,3-dihydro-1H-inden-1-ol |
| SMILES | Cc1cc(F)cc2c1CCC2O |
| InChI | InChI=1S/C10H11FO/c1-6-4-7(11)5-9-8(6)2-3-10(9)12/h4-5,10,12H,2-3H2,1H3 |
| InChIKey | XJWJGBBONNDQCY-UHFFFAOYSA-N |
| XLogP | 2.11 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 166.19 |
| LogP ≤ 5 | 2.11 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 6-fluoro-4-methyl-2,3-dihydro-1H-inden-1-ol?
The IUPAC name of 6-fluoro-4-methyl-2,3-dihydro-1H-inden-1-ol (CID 62124897) is 6-fluoro-4-methyl-2,3-dihydro-1H-inden-1-ol.
What is the SMILES notation for 6-fluoro-4-methyl-2,3-dihydro-1H-inden-1-ol?
The canonical SMILES for 6-fluoro-4-methyl-2,3-dihydro-1H-inden-1-ol is Cc1cc(F)cc2c1CCC2O.
What is the InChIKey of 6-fluoro-4-methyl-2,3-dihydro-1H-inden-1-ol?
The InChIKey is XJWJGBBONNDQCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FO/c1-6-4-7(11)5-9-8(6)2-3-10(9)12/h4-5,10,12H,2-3H2,1H3.
What are the key properties of 6-fluoro-4-methyl-2,3-dihydro-1H-inden-1-ol?
6-fluoro-4-methyl-2,3-dihydro-1H-inden-1-ol has a molecular weight of 166.19 g/mol, XLogP of 2.11, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-4-methyl-2,3-dihydro-1H-inden-1-ol is sourced from PubChem (CID 62124897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).