9-(4-carbazol-9-ylphenyl)-3-[9-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]-2,7-dimethylfluoren-9-yl]carbazole

C75H50N4 — CID 58412014

IUPAC9-(4-carbazol-9-ylphenyl)-3-[9-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]-2,7-dimethylfluoren-9-yl]carbazole
SMILESCc1ccc2c(c1)C(c1ccc3c(c1)c1ccccc1n3-c1ccc(-n3c4ccccc4c4ccccc43)cc1)(c1ccc3c(c1)c1ccccc1n3-c1ccc(-n3c4ccccc4c4ccccc43)cc1)c1cc(C)ccc1-2
InChIInChI=1S/C75H50N4/c1-47-27-39-55-56-40-28-48(2)44-66(56)75(65(55)43-47,49-29-41-73-63(45-49)61-19-7-13-25-71(61)78(73)53-35-31-51(32-36-53)76-67-21-9-3-15-57(67)58-16-4-10-22-68(58)76)50-30-42-74-64(46-50)62-20-8-14-26-72(62)79(74)54-37-33-52(34-38-54)77-69-23-11-5-17-59(69)60-18-6-12-24-70(60)77/h3-46H,1-2H3
InChIKeyVIIXULYTRKXVOR-UHFFFAOYSA-N
MW1007.25 g/mol
LogP19.05
Rot. Bonds6

About 9-(4-carbazol-9-ylphenyl)-3-[9-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]-2,7-dimethylfluoren-9-yl]carbazole

9-(4-carbazol-9-ylphenyl)-3-[9-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]-2,7-dimethylfluoren-9-yl]carbazole (PubChem CID 58412014) has the molecular formula C75H50N4 and a molecular weight of 1007.25 g/mol. Its IUPAC name is 9-(4-carbazol-9-ylphenyl)-3-[9-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]-2,7-dimethylfluoren-9-yl]carbazole.

Molecular Properties

Compound Name9-(4-carbazol-9-ylphenyl)-3-[9-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]-2,7-dimethylfluoren-9-yl]carbazole
PubChem CID58412014
Molecular FormulaC75H50N4
Molecular Weight1007.25 g/mol
Exact Mass1006.40
IUPAC Name9-(4-carbazol-9-ylphenyl)-3-[9-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]-2,7-dimethylfluoren-9-yl]carbazole
SMILESCc1ccc2c(c1)C(c1ccc3c(c1)c1ccccc1n3-c1ccc(-n3c4ccccc4c4ccccc43)cc1)(c1ccc3c(c1)c1ccccc1n3-c1ccc(-n3c4ccccc4c4ccccc43)cc1)c1cc(C)ccc1-2
InChIInChI=1S/C75H50N4/c1-47-27-39-55-56-40-28-48(2)44-66(56)75(65(55)43-47,49-29-41-73-63(45-49)61-19-7-13-25-71(61)78(73)53-35-31-51(32-36-53)76-67-21-9-3-15-57(67)58-16-4-10-22-68(58)76)50-30-42-74-64(46-50)62-20-8-14-26-72(62)79(74)54-37-33-52(34-38-54)77-69-23-11-5-17-59(69)60-18-6-12-24-70(60)77/h3-46H,1-2H3
InChIKeyVIIXULYTRKXVOR-UHFFFAOYSA-N
XLogP19.05
TPSA19.72 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms79
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001007.25
LogP ≤ 519.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-[2,7-dibromo-9-(9-phenylcarbazol-3-yl)fluoren-9-yl]-9-phenylcarbazole
CID 102125302
9-[9,9-dimethyl-7-(3-methylcarbazol-9-yl)fluoren-2-yl]-3-methylcarbazole
CID 86066589
9-(9,9-diphenylfluoren-2-yl)-3-methylcarbazole;9-(9H-fluoren-2-yl)-3-methylcarbazole;3-methyl-9-[4-(9-phenylfluoren-9-yl)phenyl]carbazole;3-methyl-9-(9,9'-spirobi[fluorene]-2-yl)carbazole
CID 160834176
5'-[9-(4-methylphenyl)carbazol-3-yl]spiro[fluorene-9,11'-indeno[1,2-b]carbazole]
CID 167052788
9,11,11-trimethyl-5-phenylindeno[1,2-b]carbazole
CID 71250183
3-[4-[9,9-diphenyl-7-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-yl]phenyl]-9-phenylcarbazole
CID 89118693
3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-9-[4-(4-methylphenyl)phenyl]carbazole;3-[9-(9,9-diphenylfluoren-2-yl)carbazol-3-yl]-9-[4-(4-methylphenyl)phenyl]carbazole
CID 162026936
CID 163750007
CID 163750007
2-[2,7-dibromo-9-(9-phenylcarbazol-2-yl)fluoren-9-yl]-9-phenylcarbazole
CID 174722442
3-methyl-9-(4-methylphenyl)-6-[9-(4-methylphenyl)-6-[9-(4-methylphenyl)carbazol-3-yl]carbazol-3-yl]carbazole
CID 70866701
3-carbazol-9-yl-9-(4-methylphenyl)sulfonyl-6-(9-phenylfluoren-9-yl)carbazole
CID 167052770
3-[9-(9,9-diphenylfluoren-2-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 118449222

Frequently Asked Questions

What is the IUPAC name of 9-(4-carbazol-9-ylphenyl)-3-[9-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]-2,7-dimethylfluoren-9-yl]carbazole?
The IUPAC name of 9-(4-carbazol-9-ylphenyl)-3-[9-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]-2,7-dimethylfluoren-9-yl]carbazole (CID 58412014) is 9-(4-carbazol-9-ylphenyl)-3-[9-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]-2,7-dimethylfluoren-9-yl]carbazole.
What is the SMILES notation for 9-(4-carbazol-9-ylphenyl)-3-[9-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]-2,7-dimethylfluoren-9-yl]carbazole?
The canonical SMILES for 9-(4-carbazol-9-ylphenyl)-3-[9-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]-2,7-dimethylfluoren-9-yl]carbazole is Cc1ccc2c(c1)C(c1ccc3c(c1)c1ccccc1n3-c1ccc(-n3c4ccccc4c4ccccc43)cc1)(c1ccc3c(c1)c1ccccc1n3-c1ccc(-n3c4ccccc4c4ccccc43)cc1)c1cc(C)ccc1-2.
What is the InChIKey of 9-(4-carbazol-9-ylphenyl)-3-[9-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]-2,7-dimethylfluoren-9-yl]carbazole?
The InChIKey is VIIXULYTRKXVOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C75H50N4/c1-47-27-39-55-56-40-28-48(2)44-66(56)75(65(55)43-47,49-29-41-73-63(45-49)61-19-7-13-25-71(61)78(73)53-35-31-51(32-36-53)76-67-21-9-3-15-57(67)58-16-4-10-22-68(58)76)50-30-42-74-64(46-50)62-20-8-14-26-72(62)79(74)54-37-33-52(34-38-54)77-69-23-11-5-17-59(69)60-18-6-12-24-70(60)77/h3-46H,1-2H3.
What are the key properties of 9-(4-carbazol-9-ylphenyl)-3-[9-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]-2,7-dimethylfluoren-9-yl]carbazole?
9-(4-carbazol-9-ylphenyl)-3-[9-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]-2,7-dimethylfluoren-9-yl]carbazole has a molecular weight of 1007.25 g/mol, XLogP of 19.05, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-carbazol-9-ylphenyl)-3-[9-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]-2,7-dimethylfluoren-9-yl]carbazole is sourced from PubChem (CID 58412014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).