9-[3,5-bis[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]-3,6-bis(4-fluorophenyl)carbazole;2-[3,5-bis(9,9-dimethylfluoren-2-yl)-2,4,6-trifluorophenyl]-9,9-dimethylfluorene;9-[4-[4-[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]phenyl]-3,6-bis(4-fluorophenyl)carbazole

C189H120F13N5 — CID 158293386

IUPAC9-[3,5-bis[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]-3,6-bis(4-fluorophenyl)carbazole;2-[3,5-bis(9,9-dimethylfluoren-2-yl)-2,4,6-trifluorophenyl]-9,9-dimethylfluorene;9-[4-[4-[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]phenyl]-3,6-bis(4-fluorophenyl)carbazole
SMILESCC1(C)c2ccccc2-c2ccc(-c3c(F)c(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)c(F)c(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)c3F)cc21.Fc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(F)cc4)ccc2n3-c2cc(-n3c4ccc(-c5ccc(F)cc5)cc4c4cc(-c5ccc(F)cc5)ccc43)cc(-n3c4ccc(-c5ccc(F)cc5)cc4c4cc(-c5ccc(F)cc5)ccc43)c2)cc1.Fc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(F)cc4)ccc2n3-c2ccc(-c3ccc(-n4c5ccc(-c6ccc(F)cc6)cc5c5cc(-c6ccc(F)cc6)ccc54)cc3)cc2)cc1
InChIInChI=1S/C78H45F6N3.C60H36F4N2.C51H39F3/c79-58-19-1-46(2-20-58)52-13-31-73-67(37-52)68-38-53(47-3-21-59(80)22-4-47)14-32-74(68)85(73)64-43-65(86-75-33-15-54(48-5-23-60(81)24-6-48)39-69(75)70-40-55(16-34-76(70)86)49-7-25-61(82)26-8-49)45-66(44-64)87-77-35-17-56(50-9-27-62(83)28-10-50)41-71(77)72-42-57(18-36-78(72)87)51-11-29-63(84)30-12-51;61-47-17-1-39(2-18-47)43-13-29-57-53(33-43)54-34-44(40-3-19-48(62)20-4-40)14-30-58(54)65(57)51-25-9-37(10-26-51)38-11-27-52(28-12-38)66-59-31-15-45(41-5-21-49(63)22-6-41)35-55(59)56-36-46(16-32-60(56)66)42-7-23-50(64)24-8-42;1-49(2)37-16-10-7-13-31(37)34-22-19-28(25-40(34)49)43-46(52)44(29-20-23-35-32-14-8-11-17-38(32)50(3,4)41(35)26-29)48(54)45(47(43)53)30-21-24-36-33-15-9-12-18-39(33)51(5,6)42(36)27-30/h1-45H;1-36H;7-27H,1-6H3
InChIKeyGLPWGJWNXPNNKE-UHFFFAOYSA-N
MW2708.05 g/mol
LogP52.61
Rot. Bonds19

About 9-[3,5-bis[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]-3,6-bis(4-fluorophenyl)carbazole;2-[3,5-bis(9,9-dimethylfluoren-2-yl)-2,4,6-trifluorophenyl]-9,9-dimethylfluorene;9-[4-[4-[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]phenyl]-3,6-bis(4-fluorophenyl)carbazole

9-[3,5-bis[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]-3,6-bis(4-fluorophenyl)carbazole;2-[3,5-bis(9,9-dimethylfluoren-2-yl)-2,4,6-trifluorophenyl]-9,9-dimethylfluorene;9-[4-[4-[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]phenyl]-3,6-bis(4-fluorophenyl)carbazole (PubChem CID 158293386) has the molecular formula C189H120F13N5 and a molecular weight of 2708.05 g/mol. Its IUPAC name is 9-[3,5-bis[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]-3,6-bis(4-fluorophenyl)carbazole;2-[3,5-bis(9,9-dimethylfluoren-2-yl)-2,4,6-trifluorophenyl]-9,9-dimethylfluorene;9-[4-[4-[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]phenyl]-3,6-bis(4-fluorophenyl)carbazole.

Molecular Properties

Compound Name9-[3,5-bis[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]-3,6-bis(4-fluorophenyl)carbazole;2-[3,5-bis(9,9-dimethylfluoren-2-yl)-2,4,6-trifluorophenyl]-9,9-dimethylfluorene;9-[4-[4-[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]phenyl]-3,6-bis(4-fluorophenyl)carbazole
PubChem CID158293386
Molecular FormulaC189H120F13N5
Molecular Weight2708.05 g/mol
Exact Mass2705.93
IUPAC Name9-[3,5-bis[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]-3,6-bis(4-fluorophenyl)carbazole;2-[3,5-bis(9,9-dimethylfluoren-2-yl)-2,4,6-trifluorophenyl]-9,9-dimethylfluorene;9-[4-[4-[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]phenyl]-3,6-bis(4-fluorophenyl)carbazole
SMILESCC1(C)c2ccccc2-c2ccc(-c3c(F)c(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)c(F)c(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)c3F)cc21.Fc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(F)cc4)ccc2n3-c2cc(-n3c4ccc(-c5ccc(F)cc5)cc4c4cc(-c5ccc(F)cc5)ccc43)cc(-n3c4ccc(-c5ccc(F)cc5)cc4c4cc(-c5ccc(F)cc5)ccc43)c2)cc1.Fc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(F)cc4)ccc2n3-c2ccc(-c3ccc(-n4c5ccc(-c6ccc(F)cc6)cc5c5cc(-c6ccc(F)cc6)ccc54)cc3)cc2)cc1
InChIInChI=1S/C78H45F6N3.C60H36F4N2.C51H39F3/c79-58-19-1-46(2-20-58)52-13-31-73-67(37-52)68-38-53(47-3-21-59(80)22-4-47)14-32-74(68)85(73)64-43-65(86-75-33-15-54(48-5-23-60(81)24-6-48)39-69(75)70-40-55(16-34-76(70)86)49-7-25-61(82)26-8-49)45-66(44-64)87-77-35-17-56(50-9-27-62(83)28-10-50)41-71(77)72-42-57(18-36-78(72)87)51-11-29-63(84)30-12-51;61-47-17-1-39(2-18-47)43-13-29-57-53(33-43)54-34-44(40-3-19-48(62)20-4-40)14-30-58(54)65(57)51-25-9-37(10-26-51)38-11-27-52(28-12-38)66-59-31-15-45(41-5-21-49(63)22-6-41)35-55(59)56-36-46(16-32-60(56)66)42-7-23-50(64)24-8-42;1-49(2)37-16-10-7-13-31(37)34-22-19-28(25-40(34)49)43-46(52)44(29-20-23-35-32-14-8-11-17-38(32)50(3,4)41(35)26-29)48(54)45(47(43)53)30-21-24-36-33-15-9-12-18-39(33)51(5,6)42(36)27-30/h1-45H;1-36H;7-27H,1-6H3
InChIKeyGLPWGJWNXPNNKE-UHFFFAOYSA-N
XLogP52.61
TPSA24.65 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds19
Heavy Atoms207
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002708.05
LogP ≤ 552.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 9-[3,5-bis[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]-3,6-bis(4-fluorophenyl)carbazole;2-[3,5-bis(9,9-dimethylfluoren-2-yl)-2,4,6-trifluorophenyl]-9,9-dimethylfluorene;9-[4-[4-[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]phenyl]-3,6-bis(4-fluorophenyl)carbazole with MolForge

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Related Compounds

9-(9,9-dimethyl-7-phenylfluoren-2-yl)-3,6-diphenylcarbazole
CID 118475086
7,7-dimethyl-5-(4-phenylphenyl)-2-[6-phenyl-9-(4-phenylphenyl)carbazol-3-yl]indeno[2,1-b]carbazole
CID 89472227
9-[7-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]-9,9-dimethylfluoren-2-yl]carbazole
CID 58676147
3,6-bis[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole
CID 59306698
3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 163801693
3-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9-(3,5-diphenylphenyl)carbazole
CID 129311960
N-(9,9-dimethylfluoren-2-yl)-7-[9-(4-fluorophenyl)carbazol-3-yl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine
CID 59171791
3-[3-(9,9-dimethylfluoren-2-yl)phenyl]-9-(3,5-diphenylphenyl)carbazole
CID 129311922
14-(4-fluorophenyl)-10,10,21,21-tetramethyl-18-(9-phenylcarbazol-3-yl)-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15(20),16,18-nonaene
CID 118227839
N-(4-dibenzothiophen-3-ylphenyl)-4-(4-fluorophenyl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]-4-(9-phenylcarbazol-3-yl)aniline
CID 159762340
3-(9,9-dimethylfluoren-2-yl)-9-(3,5-diphenylphenyl)-6-(9-phenylcarbazol-3-yl)carbazole;9-(3,5-diphenylphenyl)-3-phenyl-6-(9-phenylcarbazol-3-yl)carbazole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)carbazole
CID 158206724
3-(9,9-dimethylfluoren-2-yl)-9-phenyl-6-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole
CID 145327687

Frequently Asked Questions

What is the IUPAC name of 9-[3,5-bis[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]-3,6-bis(4-fluorophenyl)carbazole;2-[3,5-bis(9,9-dimethylfluoren-2-yl)-2,4,6-trifluorophenyl]-9,9-dimethylfluorene;9-[4-[4-[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]phenyl]-3,6-bis(4-fluorophenyl)carbazole?
The IUPAC name of 9-[3,5-bis[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]-3,6-bis(4-fluorophenyl)carbazole;2-[3,5-bis(9,9-dimethylfluoren-2-yl)-2,4,6-trifluorophenyl]-9,9-dimethylfluorene;9-[4-[4-[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]phenyl]-3,6-bis(4-fluorophenyl)carbazole (CID 158293386) is 9-[3,5-bis[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]-3,6-bis(4-fluorophenyl)carbazole;2-[3,5-bis(9,9-dimethylfluoren-2-yl)-2,4,6-trifluorophenyl]-9,9-dimethylfluorene;9-[4-[4-[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]phenyl]-3,6-bis(4-fluorophenyl)carbazole.
What is the SMILES notation for 9-[3,5-bis[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]-3,6-bis(4-fluorophenyl)carbazole;2-[3,5-bis(9,9-dimethylfluoren-2-yl)-2,4,6-trifluorophenyl]-9,9-dimethylfluorene;9-[4-[4-[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]phenyl]-3,6-bis(4-fluorophenyl)carbazole?
The canonical SMILES for 9-[3,5-bis[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]-3,6-bis(4-fluorophenyl)carbazole;2-[3,5-bis(9,9-dimethylfluoren-2-yl)-2,4,6-trifluorophenyl]-9,9-dimethylfluorene;9-[4-[4-[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]phenyl]-3,6-bis(4-fluorophenyl)carbazole is CC1(C)c2ccccc2-c2ccc(-c3c(F)c(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)c(F)c(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)c3F)cc21.Fc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(F)cc4)ccc2n3-c2cc(-n3c4ccc(-c5ccc(F)cc5)cc4c4cc(-c5ccc(F)cc5)ccc43)cc(-n3c4ccc(-c5ccc(F)cc5)cc4c4cc(-c5ccc(F)cc5)ccc43)c2)cc1.Fc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(F)cc4)ccc2n3-c2ccc(-c3ccc(-n4c5ccc(-c6ccc(F)cc6)cc5c5cc(-c6ccc(F)cc6)ccc54)cc3)cc2)cc1.
What is the InChIKey of 9-[3,5-bis[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]-3,6-bis(4-fluorophenyl)carbazole;2-[3,5-bis(9,9-dimethylfluoren-2-yl)-2,4,6-trifluorophenyl]-9,9-dimethylfluorene;9-[4-[4-[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]phenyl]-3,6-bis(4-fluorophenyl)carbazole?
The InChIKey is GLPWGJWNXPNNKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C78H45F6N3.C60H36F4N2.C51H39F3/c79-58-19-1-46(2-20-58)52-13-31-73-67(37-52)68-38-53(47-3-21-59(80)22-4-47)14-32-74(68)85(73)64-43-65(86-75-33-15-54(48-5-23-60(81)24-6-48)39-69(75)70-40-55(16-34-76(70)86)49-7-25-61(82)26-8-49)45-66(44-64)87-77-35-17-56(50-9-27-62(83)28-10-50)41-71(77)72-42-57(18-36-78(72)87)51-11-29-63(84)30-12-51;61-47-17-1-39(2-18-47)43-13-29-57-53(33-43)54-34-44(40-3-19-48(62)20-4-40)14-30-58(54)65(57)51-25-9-37(10-26-51)38-11-27-52(28-12-38)66-59-31-15-45(41-5-21-49(63)22-6-41)35-55(59)56-36-46(16-32-60(56)66)42-7-23-50(64)24-8-42;1-49(2)37-16-10-7-13-31(37)34-22-19-28(25-40(34)49)43-46(52)44(29-20-23-35-32-14-8-11-17-38(32)50(3,4)41(35)26-29)48(54)45(47(43)53)30-21-24-36-33-15-9-12-18-39(33)51(5,6)42(36)27-30/h1-45H;1-36H;7-27H,1-6H3.
What are the key properties of 9-[3,5-bis[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]-3,6-bis(4-fluorophenyl)carbazole;2-[3,5-bis(9,9-dimethylfluoren-2-yl)-2,4,6-trifluorophenyl]-9,9-dimethylfluorene;9-[4-[4-[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]phenyl]-3,6-bis(4-fluorophenyl)carbazole?
9-[3,5-bis[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]-3,6-bis(4-fluorophenyl)carbazole;2-[3,5-bis(9,9-dimethylfluoren-2-yl)-2,4,6-trifluorophenyl]-9,9-dimethylfluorene;9-[4-[4-[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]phenyl]-3,6-bis(4-fluorophenyl)carbazole has a molecular weight of 2708.05 g/mol, XLogP of 52.61, 19 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3,5-bis[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]-3,6-bis(4-fluorophenyl)carbazole;2-[3,5-bis(9,9-dimethylfluoren-2-yl)-2,4,6-trifluorophenyl]-9,9-dimethylfluorene;9-[4-[4-[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]phenyl]-3,6-bis(4-fluorophenyl)carbazole is sourced from PubChem (CID 158293386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).