2-(trifluoromethoxy)-9H-carbazole

C13H8F3NO — CID 46855213

IUPAC2-(trifluoromethoxy)-9H-carbazole
SMILESFC(F)(F)Oc1ccc2c(c1)[nH]c1ccccc12
InChIInChI=1S/C13H8F3NO/c14-13(15,16)18-8-5-6-10-9-3-1-2-4-11(9)17-12(10)7-8/h1-7,17H
InChIKeyAKPHYUFLAWJLFA-UHFFFAOYSA-N
MW251.21 g/mol
LogP4.22
Rot. Bonds1

About 2-(trifluoromethoxy)-9H-carbazole

2-(trifluoromethoxy)-9H-carbazole (PubChem CID 46855213) has the molecular formula C13H8F3NO and a molecular weight of 251.21 g/mol. Its IUPAC name is 2-(trifluoromethoxy)-9H-carbazole.

Molecular Properties

Compound Name2-(trifluoromethoxy)-9H-carbazole
PubChem CID46855213
Molecular FormulaC13H8F3NO
Molecular Weight251.21 g/mol
Exact Mass251.06
IUPAC Name2-(trifluoromethoxy)-9H-carbazole
SMILESFC(F)(F)Oc1ccc2c(c1)[nH]c1ccccc12
InChIInChI=1S/C13H8F3NO/c14-13(15,16)18-8-5-6-10-9-3-1-2-4-11(9)17-12(10)7-8/h1-7,17H
InChIKeyAKPHYUFLAWJLFA-UHFFFAOYSA-N
XLogP4.22
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.21
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(trifluoromethoxy)-9H-carbazole?
The IUPAC name of 2-(trifluoromethoxy)-9H-carbazole (CID 46855213) is 2-(trifluoromethoxy)-9H-carbazole.
What is the SMILES notation for 2-(trifluoromethoxy)-9H-carbazole?
The canonical SMILES for 2-(trifluoromethoxy)-9H-carbazole is FC(F)(F)Oc1ccc2c(c1)[nH]c1ccccc12.
What is the InChIKey of 2-(trifluoromethoxy)-9H-carbazole?
The InChIKey is AKPHYUFLAWJLFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8F3NO/c14-13(15,16)18-8-5-6-10-9-3-1-2-4-11(9)17-12(10)7-8/h1-7,17H.
What are the key properties of 2-(trifluoromethoxy)-9H-carbazole?
2-(trifluoromethoxy)-9H-carbazole has a molecular weight of 251.21 g/mol, XLogP of 4.22, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trifluoromethoxy)-9H-carbazole is sourced from PubChem (CID 46855213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).