2,4-difluoro-6-methoxy-9H-carbazole

C13H9F2NO — CID 171714920

IUPAC2,4-difluoro-6-methoxy-9H-carbazole
SMILESCOc1ccc2[nH]c3cc(F)cc(F)c3c2c1
InChIInChI=1S/C13H9F2NO/c1-17-8-2-3-11-9(6-8)13-10(15)4-7(14)5-12(13)16-11/h2-6,16H,1H3
InChIKeyRGMSDLYDGKENPA-UHFFFAOYSA-N
MW233.22 g/mol
LogP3.61
Rot. Bonds1

About 2,4-difluoro-6-methoxy-9H-carbazole

2,4-difluoro-6-methoxy-9H-carbazole (PubChem CID 171714920) has the molecular formula C13H9F2NO and a molecular weight of 233.22 g/mol. Its IUPAC name is 2,4-difluoro-6-methoxy-9H-carbazole.

Molecular Properties

Compound Name2,4-difluoro-6-methoxy-9H-carbazole
PubChem CID171714920
Molecular FormulaC13H9F2NO
Molecular Weight233.22 g/mol
Exact Mass233.07
IUPAC Name2,4-difluoro-6-methoxy-9H-carbazole
SMILESCOc1ccc2[nH]c3cc(F)cc(F)c3c2c1
InChIInChI=1S/C13H9F2NO/c1-17-8-2-3-11-9(6-8)13-10(15)4-7(14)5-12(13)16-11/h2-6,16H,1H3
InChIKeyRGMSDLYDGKENPA-UHFFFAOYSA-N
XLogP3.61
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.22
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-6-methoxy-9H-carbazole?
The IUPAC name of 2,4-difluoro-6-methoxy-9H-carbazole (CID 171714920) is 2,4-difluoro-6-methoxy-9H-carbazole.
What is the SMILES notation for 2,4-difluoro-6-methoxy-9H-carbazole?
The canonical SMILES for 2,4-difluoro-6-methoxy-9H-carbazole is COc1ccc2[nH]c3cc(F)cc(F)c3c2c1.
What is the InChIKey of 2,4-difluoro-6-methoxy-9H-carbazole?
The InChIKey is RGMSDLYDGKENPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9F2NO/c1-17-8-2-3-11-9(6-8)13-10(15)4-7(14)5-12(13)16-11/h2-6,16H,1H3.
What are the key properties of 2,4-difluoro-6-methoxy-9H-carbazole?
2,4-difluoro-6-methoxy-9H-carbazole has a molecular weight of 233.22 g/mol, XLogP of 3.61, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-difluoro-6-methoxy-9H-carbazole is sourced from PubChem (CID 171714920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).