9-[2,5-bis(trifluoromethyl)phenyl]carbazole

C20H11F6N — CID 122431295

IUPAC9-[2,5-bis(trifluoromethyl)phenyl]carbazole
SMILESFC(F)(F)c1ccc(C(F)(F)F)c(-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C20H11F6N/c21-19(22,23)12-9-10-15(20(24,25)26)18(11-12)27-16-7-3-1-5-13(16)14-6-2-4-8-17(14)27/h1-11H
InChIKeyMPJGNHWDVNFYSI-UHFFFAOYSA-N
MW379.30 g/mol
LogP6.82
Rot. Bonds1

About 9-[2,5-bis(trifluoromethyl)phenyl]carbazole

9-[2,5-bis(trifluoromethyl)phenyl]carbazole (PubChem CID 122431295) has the molecular formula C20H11F6N and a molecular weight of 379.30 g/mol. Its IUPAC name is 9-[2,5-bis(trifluoromethyl)phenyl]carbazole.

Molecular Properties

Compound Name9-[2,5-bis(trifluoromethyl)phenyl]carbazole
PubChem CID122431295
Molecular FormulaC20H11F6N
Molecular Weight379.30 g/mol
Exact Mass379.08
IUPAC Name9-[2,5-bis(trifluoromethyl)phenyl]carbazole
SMILESFC(F)(F)c1ccc(C(F)(F)F)c(-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C20H11F6N/c21-19(22,23)12-9-10-15(20(24,25)26)18(11-12)27-16-7-3-1-5-13(16)14-6-2-4-8-17(14)27/h1-11H
InChIKeyMPJGNHWDVNFYSI-UHFFFAOYSA-N
XLogP6.82
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500379.30
LogP ≤ 56.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9-[4-carbazol-9-yl-2,5-bis(trifluoromethyl)phenyl]carbazole
CID 135136219
9-[2,5-bis(trifluoromethyl)phenyl]-3,6-diphenylcarbazole
CID 122431504
9-(2,5-ditert-butylphenyl)carbazole
CID 143599034
2,7-di(carbazol-9-yl)-9-[5-[3-[2,7-di(carbazol-9-yl)carbazol-9-yl]-4-(trifluoromethyl)phenyl]-2-(trifluoromethyl)phenyl]carbazole
CID 138736236
9-[2-carbazol-9-yl-4-[4,5-di(carbazol-9-yl)-2-(trifluoromethyl)phenyl]-5-(trifluoromethyl)phenyl]carbazole
CID 166982249
9-[5-[3-[2,7-bis[4-(trifluoromethyl)phenyl]carbazol-9-yl]-4-(trifluoromethyl)phenyl]-2-(trifluoromethyl)phenyl]-2,7-bis[4-(trifluoromethyl)phenyl]carbazole
CID 147940441
3-(trifluoromethyl)-9-[4-(trifluoromethyl)-2-[3-(trifluoromethyl)carbazol-9-yl]-5-[3-(trifluoromethyl)phenyl]phenyl]carbazole
CID 162610974
3,6-bis[3,5-bis[4-(trifluoromethyl)phenyl]phenyl]-9-[2-(trifluoromethyl)phenyl]carbazole
CID 170285384
9-[5-[3-(2-cyanocarbazol-9-yl)-4-(trifluoromethyl)phenyl]-2-(trifluoromethyl)phenyl]carbazole-2-carbonitrile
CID 138736023
4-[4-[2,5-bis(trifluoromethyl)phenyl]-5-carbazol-9-ylnaphthalen-1-yl]-9-[8-[2,5-bis(trifluoromethyl)phenyl]naphthalen-1-yl]carbazole
CID 146638447
4-carbazol-9-yl-3-[2-carbazol-9-yl-4-(trifluoromethyl)phenyl]benzonitrile
CID 139526319
2-tert-butyl-9-[2-(2-tert-butylcarbazol-9-yl)-4-(trifluoromethyl)-5-[3-(trifluoromethyl)phenyl]phenyl]carbazole
CID 142501935

Frequently Asked Questions

What is the IUPAC name of 9-[2,5-bis(trifluoromethyl)phenyl]carbazole?
The IUPAC name of 9-[2,5-bis(trifluoromethyl)phenyl]carbazole (CID 122431295) is 9-[2,5-bis(trifluoromethyl)phenyl]carbazole.
What is the SMILES notation for 9-[2,5-bis(trifluoromethyl)phenyl]carbazole?
The canonical SMILES for 9-[2,5-bis(trifluoromethyl)phenyl]carbazole is FC(F)(F)c1ccc(C(F)(F)F)c(-n2c3ccccc3c3ccccc32)c1.
What is the InChIKey of 9-[2,5-bis(trifluoromethyl)phenyl]carbazole?
The InChIKey is MPJGNHWDVNFYSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H11F6N/c21-19(22,23)12-9-10-15(20(24,25)26)18(11-12)27-16-7-3-1-5-13(16)14-6-2-4-8-17(14)27/h1-11H.
What are the key properties of 9-[2,5-bis(trifluoromethyl)phenyl]carbazole?
9-[2,5-bis(trifluoromethyl)phenyl]carbazole has a molecular weight of 379.30 g/mol, XLogP of 6.82, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2,5-bis(trifluoromethyl)phenyl]carbazole is sourced from PubChem (CID 122431295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).