9-(2-bromo-3-carbazol-9-ylphenyl)carbazole;2-bromo-1,3-difluorobenzene;1-bromo-3-fluorobenzene;9-(3-bromophenyl)-3-carbazol-9-ylcarbazole;bis([3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]boronic acid);9H-fluorene;9-(9H-fluoren-3-yl)carbazole

C170H114B2Br4F3N9O4 — CID 159846719

IUPAC9-(2-bromo-3-carbazol-9-ylphenyl)carbazole;2-bromo-1,3-difluorobenzene;1-bromo-3-fluorobenzene;9-(3-bromophenyl)-3-carbazol-9-ylcarbazole;bis([3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]boronic acid);9H-fluorene;9-(9H-fluoren-3-yl)carbazole
SMILESBrc1c(-n2c3ccccc3c3ccccc32)cccc1-n1c2ccccc2c2ccccc21.Brc1cccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1.Fc1cccc(Br)c1.Fc1cccc(F)c1Br.OB(O)c1cccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1.OB(O)c1cccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1.c1ccc2c(c1)Cc1ccc(-n3c4ccccc4c4ccccc43)cc1-2.c1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/2C30H21BN2O2.2C30H19BrN2.C25H17N.C13H10.C6H3BrF2.C6H4BrF/c2*34-31(35)20-8-7-9-21(18-20)32-29-15-6-3-12-25(29)26-19-22(16-17-30(26)32)33-27-13-4-1-10-23(27)24-11-2-5-14-28(24)33;31-30-28(32-24-14-5-1-10-20(24)21-11-2-6-15-25(21)32)18-9-19-29(30)33-26-16-7-3-12-22(26)23-13-4-8-17-27(23)33;31-20-8-7-9-21(18-20)32-29-15-6-3-12-25(29)26-19-22(16-17-30(26)32)33-27-13-4-1-10-23(27)24-11-2-5-14-28(24)33;1-2-8-20-17(7-1)15-18-13-14-19(16-23(18)20)26-24-11-5-3-9-21(24)22-10-4-6-12-25(22)26;1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;7-6-4(8)2-1-3-5(6)9;7-5-2-1-3-6(8)4-5/h2*1-19,34-35H;2*1-19H;1-14,16H,15H2;1-8H,9H2;1-3H;1-4H
InChIKeyNPKCAHJMXDTDTQ-UHFFFAOYSA-N
MW2745.07 g/mol
LogP43.34
Rot. Bonds11

About 9-(2-bromo-3-carbazol-9-ylphenyl)carbazole;2-bromo-1,3-difluorobenzene;1-bromo-3-fluorobenzene;9-(3-bromophenyl)-3-carbazol-9-ylcarbazole;bis([3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]boronic acid);9H-fluorene;9-(9H-fluoren-3-yl)carbazole

9-(2-bromo-3-carbazol-9-ylphenyl)carbazole;2-bromo-1,3-difluorobenzene;1-bromo-3-fluorobenzene;9-(3-bromophenyl)-3-carbazol-9-ylcarbazole;bis([3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]boronic acid);9H-fluorene;9-(9H-fluoren-3-yl)carbazole (PubChem CID 159846719) has the molecular formula C170H114B2Br4F3N9O4 and a molecular weight of 2745.07 g/mol. Its IUPAC name is 9-(2-bromo-3-carbazol-9-ylphenyl)carbazole;2-bromo-1,3-difluorobenzene;1-bromo-3-fluorobenzene;9-(3-bromophenyl)-3-carbazol-9-ylcarbazole;bis([3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]boronic acid);9H-fluorene;9-(9H-fluoren-3-yl)carbazole.

Molecular Properties

Compound Name9-(2-bromo-3-carbazol-9-ylphenyl)carbazole;2-bromo-1,3-difluorobenzene;1-bromo-3-fluorobenzene;9-(3-bromophenyl)-3-carbazol-9-ylcarbazole;bis([3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]boronic acid);9H-fluorene;9-(9H-fluoren-3-yl)carbazole
PubChem CID159846719
Molecular FormulaC170H114B2Br4F3N9O4
Molecular Weight2745.07 g/mol
Exact Mass2739.59
IUPAC Name9-(2-bromo-3-carbazol-9-ylphenyl)carbazole;2-bromo-1,3-difluorobenzene;1-bromo-3-fluorobenzene;9-(3-bromophenyl)-3-carbazol-9-ylcarbazole;bis([3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]boronic acid);9H-fluorene;9-(9H-fluoren-3-yl)carbazole
SMILESBrc1c(-n2c3ccccc3c3ccccc32)cccc1-n1c2ccccc2c2ccccc21.Brc1cccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1.Fc1cccc(Br)c1.Fc1cccc(F)c1Br.OB(O)c1cccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1.OB(O)c1cccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1.c1ccc2c(c1)Cc1ccc(-n3c4ccccc4c4ccccc43)cc1-2.c1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/2C30H21BN2O2.2C30H19BrN2.C25H17N.C13H10.C6H3BrF2.C6H4BrF/c2*34-31(35)20-8-7-9-21(18-20)32-29-15-6-3-12-25(29)26-19-22(16-17-30(26)32)33-27-13-4-1-10-23(27)24-11-2-5-14-28(24)33;31-30-28(32-24-14-5-1-10-20(24)21-11-2-6-15-25(21)32)18-9-19-29(30)33-26-16-7-3-12-22(26)23-13-4-8-17-27(23)33;31-20-8-7-9-21(18-20)32-29-15-6-3-12-25(29)26-19-22(16-17-30(26)32)33-27-13-4-1-10-23(27)24-11-2-5-14-28(24)33;1-2-8-20-17(7-1)15-18-13-14-19(16-23(18)20)26-24-11-5-3-9-21(24)22-10-4-6-12-25(22)26;1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;7-6-4(8)2-1-3-5(6)9;7-5-2-1-3-6(8)4-5/h2*1-19,34-35H;2*1-19H;1-14,16H,15H2;1-8H,9H2;1-3H;1-4H
InChIKeyNPKCAHJMXDTDTQ-UHFFFAOYSA-N
XLogP43.34
TPSA125.29 Ų
H-Bond Donors4
H-Bond Acceptors13
Rotatable Bonds11
Heavy Atoms192
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002745.07
LogP ≤ 543.34
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 9-(2-bromo-3-carbazol-9-ylphenyl)carbazole;2-bromo-1,3-difluorobenzene;1-bromo-3-fluorobenzene;9-(3-bromophenyl)-3-carbazol-9-ylcarbazole;bis([3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]boronic acid);9H-fluorene;9-(9H-fluoren-3-yl)carbazole with MolForge

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Related Compounds

1-bromo-3-fluorobenzene;9-(3-bromophenyl)carbazole;9H-fluorene
CID 158559593
3-(9H-fluoren-3-yl)-6-fluoro-9-(3-fluorophenyl)carbazole;3-(9H-fluoren-3-yl)-6-fluoro-9-(4-fluorophenyl)carbazole;3-(9H-fluoren-3-yl)-9-(2-fluorophenyl)carbazole;3-(9H-fluoren-3-yl)-9-(3-fluorophenyl)carbazole;3-(9H-fluoren-3-yl)-9-(4-fluorophenyl)carbazole;3-(9H-fluoren-3-yl)-6-methyl-9-(2-methylphenyl)carbazole;3-(9H-fluoren-3-yl)-6-methyl-9-(4-methylphenyl)carbazole;3-(9H-fluoren-3-yl)-9-(2-methylphenyl)carbazole
CID 157211083
9-(3-bromophenyl)-10-phenylanthracene;9H-fluorene;9-[3-(10-phenylanthracen-9-yl)phenyl]carbazole
CID 159545933
9-(2-bromophenyl)-3-carbazol-9-ylcarbazole;3,6-ditert-butyl-9-[3-[2-(3-carbazol-9-ylcarbazol-9-yl)phenyl]phenyl]carbazole;[3-(3,6-ditert-butylcarbazol-9-yl)phenyl]boronic acid
CID 163736247
1-bromo-3-fluorobenzene;9-(3-bromophenyl)carbazole;9H-fluorene;molecular hydrogen;9-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]carbazole;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane;hydroiodide
CID 161464606
9-(6-carbazol-9-yl-9H-fluoren-3-yl)carbazole
CID 59464809
CID 158916182
CID 158916182
2-bromo-9,9-dimethylfluorene;2-bromo-9-phenylcarbazole;9H-fluoren-3-ylboronic acid;bis(2-(9H-fluoren-3-yl)-9-phenylcarbazole)
CID 158945415
3-dibenzothiophen-4-yl-9-[3-(3-dibenzothiophen-4-ylcarbazol-9-yl)phenyl]carbazole;1,3-dibromobenzene;4-(9H-fluoren-3-yl)dibenzothiophene
CID 159985652
2-(3-bromophenyl)-4-(4-phenylphenyl)quinazoline;2-carbazol-9-yl-5-[3-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]benzo[b]carbazole;3-chloro-11H-benzo[b]fluorene;2-chloro-5-[3-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]benzo[b]carbazole;9H-fluorene
CID 162194630
3-bromo-9-(9,9-dimethylfluoren-2-yl)carbazole;[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]boronic acid
CID 158986771
20-(3-bromophenyl)-17-(16-carbazol-9-yl-20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1(25),2,4,6,8,10,12,14(19),15,17,21,23-dodecaen-20-yl)-20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1(25),2,4,6,8,10,12,14(19),15,17,21,23-dodecaene
CID 172522364

Frequently Asked Questions

What is the IUPAC name of 9-(2-bromo-3-carbazol-9-ylphenyl)carbazole;2-bromo-1,3-difluorobenzene;1-bromo-3-fluorobenzene;9-(3-bromophenyl)-3-carbazol-9-ylcarbazole;bis([3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]boronic acid);9H-fluorene;9-(9H-fluoren-3-yl)carbazole?
The IUPAC name of 9-(2-bromo-3-carbazol-9-ylphenyl)carbazole;2-bromo-1,3-difluorobenzene;1-bromo-3-fluorobenzene;9-(3-bromophenyl)-3-carbazol-9-ylcarbazole;bis([3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]boronic acid);9H-fluorene;9-(9H-fluoren-3-yl)carbazole (CID 159846719) is 9-(2-bromo-3-carbazol-9-ylphenyl)carbazole;2-bromo-1,3-difluorobenzene;1-bromo-3-fluorobenzene;9-(3-bromophenyl)-3-carbazol-9-ylcarbazole;bis([3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]boronic acid);9H-fluorene;9-(9H-fluoren-3-yl)carbazole.
What is the SMILES notation for 9-(2-bromo-3-carbazol-9-ylphenyl)carbazole;2-bromo-1,3-difluorobenzene;1-bromo-3-fluorobenzene;9-(3-bromophenyl)-3-carbazol-9-ylcarbazole;bis([3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]boronic acid);9H-fluorene;9-(9H-fluoren-3-yl)carbazole?
The canonical SMILES for 9-(2-bromo-3-carbazol-9-ylphenyl)carbazole;2-bromo-1,3-difluorobenzene;1-bromo-3-fluorobenzene;9-(3-bromophenyl)-3-carbazol-9-ylcarbazole;bis([3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]boronic acid);9H-fluorene;9-(9H-fluoren-3-yl)carbazole is Brc1c(-n2c3ccccc3c3ccccc32)cccc1-n1c2ccccc2c2ccccc21.Brc1cccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1.Fc1cccc(Br)c1.Fc1cccc(F)c1Br.OB(O)c1cccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1.OB(O)c1cccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1.c1ccc2c(c1)Cc1ccc(-n3c4ccccc4c4ccccc43)cc1-2.c1ccc2c(c1)Cc1ccccc1-2.
What is the InChIKey of 9-(2-bromo-3-carbazol-9-ylphenyl)carbazole;2-bromo-1,3-difluorobenzene;1-bromo-3-fluorobenzene;9-(3-bromophenyl)-3-carbazol-9-ylcarbazole;bis([3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]boronic acid);9H-fluorene;9-(9H-fluoren-3-yl)carbazole?
The InChIKey is NPKCAHJMXDTDTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C30H21BN2O2.2C30H19BrN2.C25H17N.C13H10.C6H3BrF2.C6H4BrF/c2*34-31(35)20-8-7-9-21(18-20)32-29-15-6-3-12-25(29)26-19-22(16-17-30(26)32)33-27-13-4-1-10-23(27)24-11-2-5-14-28(24)33;31-30-28(32-24-14-5-1-10-20(24)21-11-2-6-15-25(21)32)18-9-19-29(30)33-26-16-7-3-12-22(26)23-13-4-8-17-27(23)33;31-20-8-7-9-21(18-20)32-29-15-6-3-12-25(29)26-19-22(16-17-30(26)32)33-27-13-4-1-10-23(27)24-11-2-5-14-28(24)33;1-2-8-20-17(7-1)15-18-13-14-19(16-23(18)20)26-24-11-5-3-9-21(24)22-10-4-6-12-25(22)26;1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;7-6-4(8)2-1-3-5(6)9;7-5-2-1-3-6(8)4-5/h2*1-19,34-35H;2*1-19H;1-14,16H,15H2;1-8H,9H2;1-3H;1-4H.
What are the key properties of 9-(2-bromo-3-carbazol-9-ylphenyl)carbazole;2-bromo-1,3-difluorobenzene;1-bromo-3-fluorobenzene;9-(3-bromophenyl)-3-carbazol-9-ylcarbazole;bis([3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]boronic acid);9H-fluorene;9-(9H-fluoren-3-yl)carbazole?
9-(2-bromo-3-carbazol-9-ylphenyl)carbazole;2-bromo-1,3-difluorobenzene;1-bromo-3-fluorobenzene;9-(3-bromophenyl)-3-carbazol-9-ylcarbazole;bis([3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]boronic acid);9H-fluorene;9-(9H-fluoren-3-yl)carbazole has a molecular weight of 2745.07 g/mol, XLogP of 43.34, 11 rotatable bonds, 4 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2-bromo-3-carbazol-9-ylphenyl)carbazole;2-bromo-1,3-difluorobenzene;1-bromo-3-fluorobenzene;9-(3-bromophenyl)-3-carbazol-9-ylcarbazole;bis([3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]boronic acid);9H-fluorene;9-(9H-fluoren-3-yl)carbazole is sourced from PubChem (CID 159846719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).