9-[2-(9H-fluoren-3-yl)phenyl]carbazole

C31H21N — CID 157409452

IUPAC9-[2-(9H-fluoren-3-yl)phenyl]carbazole
SMILESc1ccc2c(c1)Cc1ccc(-c3ccccc3-n3c4ccccc4c4ccccc43)cc1-2
InChIInChI=1S/C31H21N/c1-2-10-24-21(9-1)19-22-17-18-23(20-28(22)24)25-11-3-6-14-29(25)32-30-15-7-4-12-26(30)27-13-5-8-16-31(27)32/h1-18,20H,19H2
InChIKeyGRYRUYHXHHTRHW-UHFFFAOYSA-N
MW407.52 g/mol
LogP8.02
Rot. Bonds2

About 9-[2-(9H-fluoren-3-yl)phenyl]carbazole

9-[2-(9H-fluoren-3-yl)phenyl]carbazole (PubChem CID 157409452) has the molecular formula C31H21N and a molecular weight of 407.52 g/mol. Its IUPAC name is 9-[2-(9H-fluoren-3-yl)phenyl]carbazole.

Molecular Properties

Compound Name9-[2-(9H-fluoren-3-yl)phenyl]carbazole
PubChem CID157409452
Molecular FormulaC31H21N
Molecular Weight407.52 g/mol
Exact Mass407.17
IUPAC Name9-[2-(9H-fluoren-3-yl)phenyl]carbazole
SMILESc1ccc2c(c1)Cc1ccc(-c3ccccc3-n3c4ccccc4c4ccccc43)cc1-2
InChIInChI=1S/C31H21N/c1-2-10-24-21(9-1)19-22-17-18-23(20-28(22)24)25-11-3-6-14-29(25)32-30-15-7-4-12-26(30)27-13-5-8-16-31(27)32/h1-18,20H,19H2
InChIKeyGRYRUYHXHHTRHW-UHFFFAOYSA-N
XLogP8.02
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms32
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500407.52
LogP ≤ 58.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 9-[2-(9H-fluoren-3-yl)phenyl]carbazole?
The IUPAC name of 9-[2-(9H-fluoren-3-yl)phenyl]carbazole (CID 157409452) is 9-[2-(9H-fluoren-3-yl)phenyl]carbazole.
What is the SMILES notation for 9-[2-(9H-fluoren-3-yl)phenyl]carbazole?
The canonical SMILES for 9-[2-(9H-fluoren-3-yl)phenyl]carbazole is c1ccc2c(c1)Cc1ccc(-c3ccccc3-n3c4ccccc4c4ccccc43)cc1-2.
What is the InChIKey of 9-[2-(9H-fluoren-3-yl)phenyl]carbazole?
The InChIKey is GRYRUYHXHHTRHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H21N/c1-2-10-24-21(9-1)19-22-17-18-23(20-28(22)24)25-11-3-6-14-29(25)32-30-15-7-4-12-26(30)27-13-5-8-16-31(27)32/h1-18,20H,19H2.
What are the key properties of 9-[2-(9H-fluoren-3-yl)phenyl]carbazole?
9-[2-(9H-fluoren-3-yl)phenyl]carbazole has a molecular weight of 407.52 g/mol, XLogP of 8.02, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-(9H-fluoren-3-yl)phenyl]carbazole is sourced from PubChem (CID 157409452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).