9-[4-[10-(2-fluorophenyl)anthracen-9-yl]phenyl]carbazole

C38H24FN — CID 58163334

IUPAC9-[4-[10-(2-fluorophenyl)anthracen-9-yl]phenyl]carbazole
SMILESFc1ccccc1-c1c2ccccc2c(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccccc12
InChIInChI=1S/C38H24FN/c39-34-18-8-5-17-33(34)38-31-15-3-1-13-29(31)37(30-14-2-4-16-32(30)38)25-21-23-26(24-22-25)40-35-19-9-6-11-27(35)28-12-7-10-20-36(28)40/h1-24H
InChIKeyXHQNLHJMTSSGLI-UHFFFAOYSA-N
MW513.62 g/mol
LogP10.56
Rot. Bonds3

About 9-[4-[10-(2-fluorophenyl)anthracen-9-yl]phenyl]carbazole

9-[4-[10-(2-fluorophenyl)anthracen-9-yl]phenyl]carbazole (PubChem CID 58163334) has the molecular formula C38H24FN and a molecular weight of 513.62 g/mol. Its IUPAC name is 9-[4-[10-(2-fluorophenyl)anthracen-9-yl]phenyl]carbazole.

Molecular Properties

Compound Name9-[4-[10-(2-fluorophenyl)anthracen-9-yl]phenyl]carbazole
PubChem CID58163334
Molecular FormulaC38H24FN
Molecular Weight513.62 g/mol
Exact Mass513.19
IUPAC Name9-[4-[10-(2-fluorophenyl)anthracen-9-yl]phenyl]carbazole
SMILESFc1ccccc1-c1c2ccccc2c(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccccc12
InChIInChI=1S/C38H24FN/c39-34-18-8-5-17-33(34)38-31-15-3-1-13-29(31)37(30-14-2-4-16-32(30)38)25-21-23-26(24-22-25)40-35-19-9-6-11-27(35)28-12-7-10-20-36(28)40/h1-24H
InChIKeyXHQNLHJMTSSGLI-UHFFFAOYSA-N
XLogP10.56
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500513.62
LogP ≤ 510.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 9-[4-[10-(2-fluorophenyl)anthracen-9-yl]phenyl]carbazole?
The IUPAC name of 9-[4-[10-(2-fluorophenyl)anthracen-9-yl]phenyl]carbazole (CID 58163334) is 9-[4-[10-(2-fluorophenyl)anthracen-9-yl]phenyl]carbazole.
What is the SMILES notation for 9-[4-[10-(2-fluorophenyl)anthracen-9-yl]phenyl]carbazole?
The canonical SMILES for 9-[4-[10-(2-fluorophenyl)anthracen-9-yl]phenyl]carbazole is Fc1ccccc1-c1c2ccccc2c(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccccc12.
What is the InChIKey of 9-[4-[10-(2-fluorophenyl)anthracen-9-yl]phenyl]carbazole?
The InChIKey is XHQNLHJMTSSGLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H24FN/c39-34-18-8-5-17-33(34)38-31-15-3-1-13-29(31)37(30-14-2-4-16-32(30)38)25-21-23-26(24-22-25)40-35-19-9-6-11-27(35)28-12-7-10-20-36(28)40/h1-24H.
What are the key properties of 9-[4-[10-(2-fluorophenyl)anthracen-9-yl]phenyl]carbazole?
9-[4-[10-(2-fluorophenyl)anthracen-9-yl]phenyl]carbazole has a molecular weight of 513.62 g/mol, XLogP of 10.56, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[10-(2-fluorophenyl)anthracen-9-yl]phenyl]carbazole is sourced from PubChem (CID 58163334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).