9-phenyl-6-(9-phenylcarbazol-3-yl)-2-(9-phenylfluoren-9-yl)carbazole

C55H36N2 — CID 118145084

IUPAC9-phenyl-6-(9-phenylcarbazol-3-yl)-2-(9-phenylfluoren-9-yl)carbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccc(C6(c7ccccc7)c7ccccc7-c7ccccc76)cc4n5-c4ccccc4)ccc32)cc1
InChIInChI=1S/C55H36N2/c1-4-16-39(17-5-1)55(49-25-13-10-22-43(49)44-23-11-14-26-50(44)55)40-30-31-46-48-35-38(29-33-53(48)57(54(46)36-40)42-20-8-3-9-21-42)37-28-32-52-47(34-37)45-24-12-15-27-51(45)56(52)41-18-6-2-7-19-41/h1-36H
InChIKeyYHORSXAEKBZUSD-UHFFFAOYSA-N
MW724.91 g/mol
LogP13.91
Rot. Bonds5

About 9-phenyl-6-(9-phenylcarbazol-3-yl)-2-(9-phenylfluoren-9-yl)carbazole

9-phenyl-6-(9-phenylcarbazol-3-yl)-2-(9-phenylfluoren-9-yl)carbazole (PubChem CID 118145084) has the molecular formula C55H36N2 and a molecular weight of 724.91 g/mol. Its IUPAC name is 9-phenyl-6-(9-phenylcarbazol-3-yl)-2-(9-phenylfluoren-9-yl)carbazole.

Molecular Properties

Compound Name9-phenyl-6-(9-phenylcarbazol-3-yl)-2-(9-phenylfluoren-9-yl)carbazole
PubChem CID118145084
Molecular FormulaC55H36N2
Molecular Weight724.91 g/mol
Exact Mass724.29
IUPAC Name9-phenyl-6-(9-phenylcarbazol-3-yl)-2-(9-phenylfluoren-9-yl)carbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccc(C6(c7ccccc7)c7ccccc7-c7ccccc76)cc4n5-c4ccccc4)ccc32)cc1
InChIInChI=1S/C55H36N2/c1-4-16-39(17-5-1)55(49-25-13-10-22-43(49)44-23-11-14-26-50(44)55)40-30-31-46-48-35-38(29-33-53(48)57(54(46)36-40)42-20-8-3-9-21-42)37-28-32-52-47(34-37)45-24-12-15-27-51(45)56(52)41-18-6-2-7-19-41/h1-36H
InChIKeyYHORSXAEKBZUSD-UHFFFAOYSA-N
XLogP13.91
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500724.91
LogP ≤ 513.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-phenyl-3-(9-phenylfluoren-9-yl)-6-[9-(3-phenylphenyl)carbazol-3-yl]carbazole
CID 121311550
3-(9-phenylcarbazol-3-yl)-9-[4-[4-[3-[9-[4-(2-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]carbazole
CID 154590784
3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[4-[4-[4-[3-[9-[4-(3-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590519
3-[9-[4-[3-[4-[3-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 154590573
3-[4-[9-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-9-yl]phenyl]-9-[3-[9-[4-[4-[9-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-9-yl]phenyl]phenyl]carbazol-3-yl]phenyl]carbazole
CID 146517009
3-[9-[3-[3-[4-[3-(9-phenylfluoren-9-yl)phenyl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 154590619
3-[9-(4-phenylphenyl)carbazol-3-yl]-9-[3-[4-[4-[3-[9-[3-(4-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590364
3-[9-(9,9-diphenylfluoren-1-yl)carbazol-3-yl]-9-phenylcarbazole
CID 118449506
3-[4-[9,9-diphenyl-7-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-yl]phenyl]-9-phenylcarbazole
CID 89118693
2-(9-phenylcarbazol-3-yl)-9-[3-(9-phenylfluoren-9-yl)phenyl]carbazole;3-[9-[3-(9-phenylfluoren-9-yl)phenyl]carbazol-2-yl]-9-(4-phenylphenyl)carbazole;3-phenyl-6-(9-phenylcarbazol-3-yl)-9-[2-(9-phenylfluoren-9-yl)phenyl]carbazole
CID 159900613
3-[9-(9,9-diphenylfluoren-2-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 118449222
9-[4-[4-[4-[4-[3-[9-(9,9-diphenylfluoren-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]phenyl]phenyl]-3-phenyl-6-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 134354328

Frequently Asked Questions

What is the IUPAC name of 9-phenyl-6-(9-phenylcarbazol-3-yl)-2-(9-phenylfluoren-9-yl)carbazole?
The IUPAC name of 9-phenyl-6-(9-phenylcarbazol-3-yl)-2-(9-phenylfluoren-9-yl)carbazole (CID 118145084) is 9-phenyl-6-(9-phenylcarbazol-3-yl)-2-(9-phenylfluoren-9-yl)carbazole.
What is the SMILES notation for 9-phenyl-6-(9-phenylcarbazol-3-yl)-2-(9-phenylfluoren-9-yl)carbazole?
The canonical SMILES for 9-phenyl-6-(9-phenylcarbazol-3-yl)-2-(9-phenylfluoren-9-yl)carbazole is c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccc(C6(c7ccccc7)c7ccccc7-c7ccccc76)cc4n5-c4ccccc4)ccc32)cc1.
What is the InChIKey of 9-phenyl-6-(9-phenylcarbazol-3-yl)-2-(9-phenylfluoren-9-yl)carbazole?
The InChIKey is YHORSXAEKBZUSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H36N2/c1-4-16-39(17-5-1)55(49-25-13-10-22-43(49)44-23-11-14-26-50(44)55)40-30-31-46-48-35-38(29-33-53(48)57(54(46)36-40)42-20-8-3-9-21-42)37-28-32-52-47(34-37)45-24-12-15-27-51(45)56(52)41-18-6-2-7-19-41/h1-36H.
What are the key properties of 9-phenyl-6-(9-phenylcarbazol-3-yl)-2-(9-phenylfluoren-9-yl)carbazole?
9-phenyl-6-(9-phenylcarbazol-3-yl)-2-(9-phenylfluoren-9-yl)carbazole has a molecular weight of 724.91 g/mol, XLogP of 13.91, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-6-(9-phenylcarbazol-3-yl)-2-(9-phenylfluoren-9-yl)carbazole is sourced from PubChem (CID 118145084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).