9-[2-fluoro-6-(2,3,4,5,6-pentafluorophenyl)phenyl]carbazole

C24H11F6N — CID 118914055

IUPAC9-[2-fluoro-6-(2,3,4,5,6-pentafluorophenyl)phenyl]carbazole
SMILESFc1cccc(-c2c(F)c(F)c(F)c(F)c2F)c1-n1c2ccccc2c2ccccc21
InChIInChI=1S/C24H11F6N/c25-15-9-5-8-14(18-19(26)21(28)23(30)22(29)20(18)27)24(15)31-16-10-3-1-6-12(16)13-7-2-4-11-17(13)31/h1-11H
InChIKeyWLFSPPAHONTUJK-UHFFFAOYSA-N
MW427.35 g/mol
LogP7.29
Rot. Bonds2

About 9-[2-fluoro-6-(2,3,4,5,6-pentafluorophenyl)phenyl]carbazole

9-[2-fluoro-6-(2,3,4,5,6-pentafluorophenyl)phenyl]carbazole (PubChem CID 118914055) has the molecular formula C24H11F6N and a molecular weight of 427.35 g/mol. Its IUPAC name is 9-[2-fluoro-6-(2,3,4,5,6-pentafluorophenyl)phenyl]carbazole.

Molecular Properties

Compound Name9-[2-fluoro-6-(2,3,4,5,6-pentafluorophenyl)phenyl]carbazole
PubChem CID118914055
Molecular FormulaC24H11F6N
Molecular Weight427.35 g/mol
Exact Mass427.08
IUPAC Name9-[2-fluoro-6-(2,3,4,5,6-pentafluorophenyl)phenyl]carbazole
SMILESFc1cccc(-c2c(F)c(F)c(F)c(F)c2F)c1-n1c2ccccc2c2ccccc21
InChIInChI=1S/C24H11F6N/c25-15-9-5-8-14(18-19(26)21(28)23(30)22(29)20(18)27)24(15)31-16-10-3-1-6-12(16)13-7-2-4-11-17(13)31/h1-11H
InChIKeyWLFSPPAHONTUJK-UHFFFAOYSA-N
XLogP7.29
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500427.35
LogP ≤ 57.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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Related Compounds

9-[2-(2,3,4,5,6-pentafluorophenyl)-4,6-bis(trifluoromethyl)phenyl]carbazole
CID 118920530
9-[3-(2,3-difluorophenyl)phenyl]carbazole
CID 122431739
5-[2-isocyano-6-(2,3,4,5,6-pentafluorophenyl)phenyl]-7,7-dimethylindeno[2,1-b]carbazole
CID 140704997
9-[4-(2,6-difluorophenyl)-2-methyl-3-(3-methylcarbazol-9-yl)phenyl]-3-methylcarbazole
CID 158882715
4-(2-carbazol-9-ylphenyl)-2,3,5,6-tetrafluorobenzonitrile
CID 139507239
1,2,3,4,5-pentafluoro-6-[2-fluoro-6-(2,3,4,5,6-pentafluorophenyl)phenyl]benzene
CID 175418212
9-[4-[10-(2-fluorophenyl)anthracen-9-yl]phenyl]carbazole
CID 58163334
9-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetrafluorophenyl]phenyl]carbazole
CID 102109316
9-[3-carbazol-9-yl-2-(2-carbazol-9-ylpropan-2-yl)-4,6-bis(2-fluorophenyl)phenyl]carbazole
CID 139552883
9-[2-(2,3-difluorophenyl)-4-pyridinyl]carbazole
CID 68513665
2-tert-butyl-9-[3-(2-tert-butylcarbazol-9-yl)-4-(2,6-difluorophenyl)-2-methylphenyl]carbazole
CID 158882718
2-[2,3-di(carbazol-9-yl)phenyl]benzene-1,3-dicarbonitrile
CID 129303673

Frequently Asked Questions

What is the IUPAC name of 9-[2-fluoro-6-(2,3,4,5,6-pentafluorophenyl)phenyl]carbazole?
The IUPAC name of 9-[2-fluoro-6-(2,3,4,5,6-pentafluorophenyl)phenyl]carbazole (CID 118914055) is 9-[2-fluoro-6-(2,3,4,5,6-pentafluorophenyl)phenyl]carbazole.
What is the SMILES notation for 9-[2-fluoro-6-(2,3,4,5,6-pentafluorophenyl)phenyl]carbazole?
The canonical SMILES for 9-[2-fluoro-6-(2,3,4,5,6-pentafluorophenyl)phenyl]carbazole is Fc1cccc(-c2c(F)c(F)c(F)c(F)c2F)c1-n1c2ccccc2c2ccccc21.
What is the InChIKey of 9-[2-fluoro-6-(2,3,4,5,6-pentafluorophenyl)phenyl]carbazole?
The InChIKey is WLFSPPAHONTUJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H11F6N/c25-15-9-5-8-14(18-19(26)21(28)23(30)22(29)20(18)27)24(15)31-16-10-3-1-6-12(16)13-7-2-4-11-17(13)31/h1-11H.
What are the key properties of 9-[2-fluoro-6-(2,3,4,5,6-pentafluorophenyl)phenyl]carbazole?
9-[2-fluoro-6-(2,3,4,5,6-pentafluorophenyl)phenyl]carbazole has a molecular weight of 427.35 g/mol, XLogP of 7.29, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-fluoro-6-(2,3,4,5,6-pentafluorophenyl)phenyl]carbazole is sourced from PubChem (CID 118914055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).