3-[10-(4-fluorophenyl)anthracen-9-yl]-9-phenylcarbazole

C38H24FN — CID 170395491

IUPAC3-[10-(4-fluorophenyl)anthracen-9-yl]-9-phenylcarbazole
SMILESFc1ccc(-c2c3ccccc3c(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3ccccc23)cc1
InChIInChI=1S/C38H24FN/c39-27-21-18-25(19-22-27)37-30-13-4-6-15-32(30)38(33-16-7-5-14-31(33)37)26-20-23-36-34(24-26)29-12-8-9-17-35(29)40(36)28-10-2-1-3-11-28/h1-24H
InChIKeyXCKHMFIAUYGLFK-UHFFFAOYSA-N
MW513.62 g/mol
LogP10.56
Rot. Bonds3

About 3-[10-(4-fluorophenyl)anthracen-9-yl]-9-phenylcarbazole

3-[10-(4-fluorophenyl)anthracen-9-yl]-9-phenylcarbazole (PubChem CID 170395491) has the molecular formula C38H24FN and a molecular weight of 513.62 g/mol. Its IUPAC name is 3-[10-(4-fluorophenyl)anthracen-9-yl]-9-phenylcarbazole.

Molecular Properties

Compound Name3-[10-(4-fluorophenyl)anthracen-9-yl]-9-phenylcarbazole
PubChem CID170395491
Molecular FormulaC38H24FN
Molecular Weight513.62 g/mol
Exact Mass513.19
IUPAC Name3-[10-(4-fluorophenyl)anthracen-9-yl]-9-phenylcarbazole
SMILESFc1ccc(-c2c3ccccc3c(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3ccccc23)cc1
InChIInChI=1S/C38H24FN/c39-27-21-18-25(19-22-27)37-30-13-4-6-15-32(30)38(33-16-7-5-14-31(33)37)26-20-23-36-34(24-26)29-12-8-9-17-35(29)40(36)28-10-2-1-3-11-28/h1-24H
InChIKeyXCKHMFIAUYGLFK-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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Related Compounds

9-phenyl-3-[4-[10-[4-(9-phenylcarbazol-3-yl)phenyl]anthracen-9-yl]phenyl]carbazole;9-phenyl-3-[4-[4-[10-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]anthracen-9-yl]phenyl]phenyl]carbazole
CID 158416546
3,6-bis[6-fluoro-9-(4-fluorophenyl)carbazol-3-yl]-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole
CID 59307012
3-(10-methylanthracen-9-yl)-9-phenylcarbazole
CID 121339805
9-phenyl-3-[9-(10-phenylanthracen-9-yl)carbazol-3-yl]carbazole
CID 168729215
N-(4-fluorophenyl)-4-(9-phenylcarbazol-3-yl)aniline
CID 59828035
9-[4-(10-phenylanthracen-9-yl)phenyl]-3,6-bis[9-(3-phenylphenyl)carbazol-3-yl]carbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]-3,6-bis[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 158633984
3-[10-(4-methylphenyl)anthracen-9-yl]-9-(4-phenylphenyl)carbazole
CID 143844267
9-phenyl-3-[2-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]carbazole
CID 146414179
5-[4-(10-phenylanthracen-9-yl)phenyl]-3-(9-phenylcarbazol-3-yl)benzo[b]carbazole
CID 153314337
3-fluoro-9-[4-[4-(3-fluorocarbazol-9-yl)phenyl]phenyl]carbazole
CID 23534181
15-[9-(3,5-diphenylphenyl)carbazol-3-yl]-10-(4-fluorophenyl)-14-phenyl-10-azapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene
CID 90336953
3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole
CID 20685483

Frequently Asked Questions

What is the IUPAC name of 3-[10-(4-fluorophenyl)anthracen-9-yl]-9-phenylcarbazole?
The IUPAC name of 3-[10-(4-fluorophenyl)anthracen-9-yl]-9-phenylcarbazole (CID 170395491) is 3-[10-(4-fluorophenyl)anthracen-9-yl]-9-phenylcarbazole.
What is the SMILES notation for 3-[10-(4-fluorophenyl)anthracen-9-yl]-9-phenylcarbazole?
The canonical SMILES for 3-[10-(4-fluorophenyl)anthracen-9-yl]-9-phenylcarbazole is Fc1ccc(-c2c3ccccc3c(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3ccccc23)cc1.
What is the InChIKey of 3-[10-(4-fluorophenyl)anthracen-9-yl]-9-phenylcarbazole?
The InChIKey is XCKHMFIAUYGLFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H24FN/c39-27-21-18-25(19-22-27)37-30-13-4-6-15-32(30)38(33-16-7-5-14-31(33)37)26-20-23-36-34(24-26)29-12-8-9-17-35(29)40(36)28-10-2-1-3-11-28/h1-24H.
What are the key properties of 3-[10-(4-fluorophenyl)anthracen-9-yl]-9-phenylcarbazole?
3-[10-(4-fluorophenyl)anthracen-9-yl]-9-phenylcarbazole 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 3-[10-(4-fluorophenyl)anthracen-9-yl]-9-phenylcarbazole is sourced from PubChem (CID 170395491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).