2,6-di(carbazol-9-yl)phenol

C30H20N2O — CID 163829206

IUPAC2,6-di(carbazol-9-yl)phenol
SMILESOc1c(-n2c3ccccc3c3ccccc32)cccc1-n1c2ccccc2c2ccccc21
InChIInChI=1S/C30H20N2O/c33-30-28(31-24-14-5-1-10-20(24)21-11-2-6-15-25(21)31)18-9-19-29(30)32-26-16-7-3-12-22(26)23-13-4-8-17-27(23)32/h1-19,33H
InChIKeyOCFHSWYMGZIKLM-UHFFFAOYSA-N
MW424.50 g/mol
LogP7.59
Rot. Bonds2

About 2,6-di(carbazol-9-yl)phenol

2,6-di(carbazol-9-yl)phenol (PubChem CID 163829206) has the molecular formula C30H20N2O and a molecular weight of 424.50 g/mol. Its IUPAC name is 2,6-di(carbazol-9-yl)phenol.

Molecular Properties

Compound Name2,6-di(carbazol-9-yl)phenol
PubChem CID163829206
Molecular FormulaC30H20N2O
Molecular Weight424.50 g/mol
Exact Mass424.16
IUPAC Name2,6-di(carbazol-9-yl)phenol
SMILESOc1c(-n2c3ccccc3c3ccccc32)cccc1-n1c2ccccc2c2ccccc21
InChIInChI=1S/C30H20N2O/c33-30-28(31-24-14-5-1-10-20(24)21-11-2-6-15-25(21)31)18-9-19-29(30)32-26-16-7-3-12-22(26)23-13-4-8-17-27(23)32/h1-19,33H
InChIKeyOCFHSWYMGZIKLM-UHFFFAOYSA-N
XLogP7.59
TPSA30.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.50
LogP ≤ 57.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,6-di(carbazol-9-yl)phenol?
The IUPAC name of 2,6-di(carbazol-9-yl)phenol (CID 163829206) is 2,6-di(carbazol-9-yl)phenol.
What is the SMILES notation for 2,6-di(carbazol-9-yl)phenol?
The canonical SMILES for 2,6-di(carbazol-9-yl)phenol is Oc1c(-n2c3ccccc3c3ccccc32)cccc1-n1c2ccccc2c2ccccc21.
What is the InChIKey of 2,6-di(carbazol-9-yl)phenol?
The InChIKey is OCFHSWYMGZIKLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H20N2O/c33-30-28(31-24-14-5-1-10-20(24)21-11-2-6-15-25(21)31)18-9-19-29(30)32-26-16-7-3-12-22(26)23-13-4-8-17-27(23)32/h1-19,33H.
What are the key properties of 2,6-di(carbazol-9-yl)phenol?
2,6-di(carbazol-9-yl)phenol has a molecular weight of 424.50 g/mol, XLogP of 7.59, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-di(carbazol-9-yl)phenol is sourced from PubChem (CID 163829206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).