9-[8-(9-fluorodibenzofuran-2-yl)dibenzofuran-2-yl]carbazole

C36H20FNO2 — CID 121420191

IUPAC9-[8-(9-fluorodibenzofuran-2-yl)dibenzofuran-2-yl]carbazole
SMILESFc1cccc2oc3ccc(-c4ccc5oc6ccc(-n7c8ccccc8c8ccccc87)cc6c5c4)cc3c12
InChIInChI=1S/C36H20FNO2/c37-29-8-5-11-35-36(29)28-19-22(13-16-34(28)40-35)21-12-15-32-26(18-21)27-20-23(14-17-33(27)39-32)38-30-9-3-1-6-24(30)25-7-2-4-10-31(25)38/h1-20H
InChIKeyFHIJUZSHDVXPTF-UHFFFAOYSA-N
MW517.56 g/mol
LogP10.39
Rot. Bonds2

About 9-[8-(9-fluorodibenzofuran-2-yl)dibenzofuran-2-yl]carbazole

9-[8-(9-fluorodibenzofuran-2-yl)dibenzofuran-2-yl]carbazole (PubChem CID 121420191) has the molecular formula C36H20FNO2 and a molecular weight of 517.56 g/mol. Its IUPAC name is 9-[8-(9-fluorodibenzofuran-2-yl)dibenzofuran-2-yl]carbazole.

Molecular Properties

Compound Name9-[8-(9-fluorodibenzofuran-2-yl)dibenzofuran-2-yl]carbazole
PubChem CID121420191
Molecular FormulaC36H20FNO2
Molecular Weight517.56 g/mol
Exact Mass517.15
IUPAC Name9-[8-(9-fluorodibenzofuran-2-yl)dibenzofuran-2-yl]carbazole
SMILESFc1cccc2oc3ccc(-c4ccc5oc6ccc(-n7c8ccccc8c8ccccc87)cc6c5c4)cc3c12
InChIInChI=1S/C36H20FNO2/c37-29-8-5-11-35-36(29)28-19-22(13-16-34(28)40-35)21-12-15-32-26(18-21)27-20-23(14-17-33(27)39-32)38-30-9-3-1-6-24(30)25-7-2-4-10-31(25)38/h1-20H
InChIKeyFHIJUZSHDVXPTF-UHFFFAOYSA-N
XLogP10.39
TPSA31.21 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500517.56
LogP ≤ 510.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-[8-(9-fluorodibenzofuran-2-yl)dibenzofuran-2-yl]carbazole?
The IUPAC name of 9-[8-(9-fluorodibenzofuran-2-yl)dibenzofuran-2-yl]carbazole (CID 121420191) is 9-[8-(9-fluorodibenzofuran-2-yl)dibenzofuran-2-yl]carbazole.
What is the SMILES notation for 9-[8-(9-fluorodibenzofuran-2-yl)dibenzofuran-2-yl]carbazole?
The canonical SMILES for 9-[8-(9-fluorodibenzofuran-2-yl)dibenzofuran-2-yl]carbazole is Fc1cccc2oc3ccc(-c4ccc5oc6ccc(-n7c8ccccc8c8ccccc87)cc6c5c4)cc3c12.
What is the InChIKey of 9-[8-(9-fluorodibenzofuran-2-yl)dibenzofuran-2-yl]carbazole?
The InChIKey is FHIJUZSHDVXPTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H20FNO2/c37-29-8-5-11-35-36(29)28-19-22(13-16-34(28)40-35)21-12-15-32-26(18-21)27-20-23(14-17-33(27)39-32)38-30-9-3-1-6-24(30)25-7-2-4-10-31(25)38/h1-20H.
What are the key properties of 9-[8-(9-fluorodibenzofuran-2-yl)dibenzofuran-2-yl]carbazole?
9-[8-(9-fluorodibenzofuran-2-yl)dibenzofuran-2-yl]carbazole has a molecular weight of 517.56 g/mol, XLogP of 10.39, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[8-(9-fluorodibenzofuran-2-yl)dibenzofuran-2-yl]carbazole is sourced from PubChem (CID 121420191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).