About 3-methoxy-9-(trifluoromethyl)carbazole
3-methoxy-9-(trifluoromethyl)carbazole (PubChem CID 153297232) has the molecular formula C14H10F3NO
and a molecular weight of 265.23 g/mol. Its IUPAC name is 3-methoxy-9-(trifluoromethyl)carbazole.
Molecular Properties
| Compound Name | 3-methoxy-9-(trifluoromethyl)carbazole |
| PubChem CID | 153297232 |
| Molecular Formula | C14H10F3NO |
| Molecular Weight | 265.23 g/mol |
| Exact Mass | 265.07 |
| IUPAC Name | 3-methoxy-9-(trifluoromethyl)carbazole |
| SMILES | COc1ccc2c(c1)c1ccccc1n2C(F)(F)F |
| InChI | InChI=1S/C14H10F3NO/c1-19-9-6-7-13-11(8-9)10-4-2-3-5-12(10)18(13)14(15,16)17/h2-8H,1H3 |
| InChIKey | MIVVMPCXKGBBFX-UHFFFAOYSA-N |
| XLogP | 4.28 |
| TPSA | 14.16 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 265.23 |
| LogP ≤ 5 | 4.28 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 3-methoxy-9-(trifluoromethyl)carbazole?
The IUPAC name of 3-methoxy-9-(trifluoromethyl)carbazole (CID 153297232) is 3-methoxy-9-(trifluoromethyl)carbazole.
What is the SMILES notation for 3-methoxy-9-(trifluoromethyl)carbazole?
The canonical SMILES for 3-methoxy-9-(trifluoromethyl)carbazole is COc1ccc2c(c1)c1ccccc1n2C(F)(F)F.
What is the InChIKey of 3-methoxy-9-(trifluoromethyl)carbazole?
The InChIKey is MIVVMPCXKGBBFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F3NO/c1-19-9-6-7-13-11(8-9)10-4-2-3-5-12(10)18(13)14(15,16)17/h2-8H,1H3.
What are the key properties of 3-methoxy-9-(trifluoromethyl)carbazole?
3-methoxy-9-(trifluoromethyl)carbazole has a molecular weight of 265.23 g/mol, XLogP of 4.28, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-9-(trifluoromethyl)carbazole is sourced from PubChem (CID 153297232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).