9-[1,2-bis(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]-3,6-ditert-butylcarbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-2-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole

C356H353N19O6 — CID 158924300

IUPAC9-[1,2-bis(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]-3,6-ditert-butylcarbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-2-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole
SMILES[C-]#[N+]c1c(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c2c(oc3c(-c4ccccc4)cccc32)c1-n1c2ccc(C(C)(C)C)cc2c2cc(C(C)(C)C)ccc21.[C-]#[N+]c1c(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc2c(oc3c(-c4ccccc4)cccc32)c1-n1c2ccc(C(C)(C)C)cc2c2cc(C(C)(C)C)ccc21.[C-]#[N+]c1c(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc2c(oc3ccccc32)c1-n1c2ccc(C(C)(C)C)cc2c2cc(C(C)(C)C)ccc21.[C-]#[N+]c1cc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c2c(oc3c(-c4ccccc4)cccc32)c1-n1c2ccc(C(C)(C)C)cc2c2cc(C(C)(C)C)ccc21.[C-]#[N+]c1cc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c2c(oc3ccccc32)c1-n1c2ccc(C(C)(C)C)cc2c2cc(C(C)(C)C)ccc21.[C-]#[N+]c1cc2oc3ccccc3c2c(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c1-n1c2ccc(C(C)(C)C)cc2c2cc(C(C)(C)C)ccc21
InChIInChI=1S/C79H80N4O.2C59H57N3O.3C53H53N3O/c1-74(2,3)47-28-34-61-55(40-47)56-41-48(75(4,5)6)29-35-62(56)81(61)69-67-54-27-23-26-53(46-24-21-20-22-25-46)72(54)84-73(67)71(83-65-38-32-51(78(13,14)15)44-59(65)60-45-52(79(16,17)18)33-39-66(60)83)68(80-19)70(69)82-63-36-30-49(76(7,8)9)42-57(63)58-43-50(77(10,11)12)31-37-64(58)82;1-56(2,3)36-22-26-47-42(30-36)43-31-37(57(4,5)6)23-27-48(43)61(47)51-34-46(60-13)53(55-52(51)41-21-17-20-40(54(41)63-55)35-18-15-14-16-19-35)62-49-28-24-38(58(7,8)9)32-44(49)45-33-39(59(10,11)12)25-29-50(45)62;1-56(2,3)36-22-26-47-42(30-36)43-31-37(57(4,5)6)23-27-48(43)61(47)51-34-46-41-21-17-20-40(35-18-15-14-16-19-35)54(41)63-55(46)53(52(51)60-13)62-49-28-24-38(58(7,8)9)32-44(49)45-33-39(59(10,11)12)25-29-50(45)62;1-50(2,3)31-18-22-41-36(26-31)37-27-32(51(4,5)6)19-23-42(37)55(41)45-30-40(54-13)48(49-47(45)35-16-14-15-17-46(35)57-49)56-43-24-20-33(52(7,8)9)28-38(43)39-29-34(53(10,11)12)21-25-44(39)56;1-50(2,3)31-18-22-41-36(26-31)37-27-32(51(4,5)6)19-23-42(37)55(41)48-40(54-13)30-46-47(35-16-14-15-17-45(35)57-46)49(48)56-43-24-20-33(52(7,8)9)28-38(43)39-29-34(53(10,11)12)21-25-44(39)56;1-50(2,3)31-18-22-41-36(26-31)37-27-32(51(4,5)6)19-23-42(37)55(41)45-30-40-35-16-14-15-17-46(35)57-49(40)48(47(45)54-13)56-43-24-20-33(52(7,8)9)28-38(43)39-29-34(53(10,11)12)21-25-44(39)56/h20-45H,1-18H3;2*14-34H,1-12H3;3*14-30H,1-12H3
InChIKeyJIFSATNXBRBMLS-UHFFFAOYSA-N
MW4993.87 g/mol
LogP103.82
Rot. Bonds16

About 9-[1,2-bis(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]-3,6-ditert-butylcarbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-2-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole

9-[1,2-bis(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]-3,6-ditert-butylcarbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-2-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole (PubChem CID 158924300) has the molecular formula C356H353N19O6 and a molecular weight of 4993.87 g/mol. Its IUPAC name is 9-[1,2-bis(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]-3,6-ditert-butylcarbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-2-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole.

Molecular Properties

Compound Name9-[1,2-bis(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]-3,6-ditert-butylcarbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-2-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole
PubChem CID158924300
Molecular FormulaC356H353N19O6
Molecular Weight4993.87 g/mol
Exact Mass4989.79
IUPAC Name9-[1,2-bis(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]-3,6-ditert-butylcarbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-2-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole
SMILES[C-]#[N+]c1c(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c2c(oc3c(-c4ccccc4)cccc32)c1-n1c2ccc(C(C)(C)C)cc2c2cc(C(C)(C)C)ccc21.[C-]#[N+]c1c(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc2c(oc3c(-c4ccccc4)cccc32)c1-n1c2ccc(C(C)(C)C)cc2c2cc(C(C)(C)C)ccc21.[C-]#[N+]c1c(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc2c(oc3ccccc32)c1-n1c2ccc(C(C)(C)C)cc2c2cc(C(C)(C)C)ccc21.[C-]#[N+]c1cc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c2c(oc3c(-c4ccccc4)cccc32)c1-n1c2ccc(C(C)(C)C)cc2c2cc(C(C)(C)C)ccc21.[C-]#[N+]c1cc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c2c(oc3ccccc32)c1-n1c2ccc(C(C)(C)C)cc2c2cc(C(C)(C)C)ccc21.[C-]#[N+]c1cc2oc3ccccc3c2c(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c1-n1c2ccc(C(C)(C)C)cc2c2cc(C(C)(C)C)ccc21
InChIInChI=1S/C79H80N4O.2C59H57N3O.3C53H53N3O/c1-74(2,3)47-28-34-61-55(40-47)56-41-48(75(4,5)6)29-35-62(56)81(61)69-67-54-27-23-26-53(46-24-21-20-22-25-46)72(54)84-73(67)71(83-65-38-32-51(78(13,14)15)44-59(65)60-45-52(79(16,17)18)33-39-66(60)83)68(80-19)70(69)82-63-36-30-49(76(7,8)9)42-57(63)58-43-50(77(10,11)12)31-37-64(58)82;1-56(2,3)36-22-26-47-42(30-36)43-31-37(57(4,5)6)23-27-48(43)61(47)51-34-46(60-13)53(55-52(51)41-21-17-20-40(54(41)63-55)35-18-15-14-16-19-35)62-49-28-24-38(58(7,8)9)32-44(49)45-33-39(59(10,11)12)25-29-50(45)62;1-56(2,3)36-22-26-47-42(30-36)43-31-37(57(4,5)6)23-27-48(43)61(47)51-34-46-41-21-17-20-40(35-18-15-14-16-19-35)54(41)63-55(46)53(52(51)60-13)62-49-28-24-38(58(7,8)9)32-44(49)45-33-39(59(10,11)12)25-29-50(45)62;1-50(2,3)31-18-22-41-36(26-31)37-27-32(51(4,5)6)19-23-42(37)55(41)45-30-40(54-13)48(49-47(45)35-16-14-15-17-46(35)57-49)56-43-24-20-33(52(7,8)9)28-38(43)39-29-34(53(10,11)12)21-25-44(39)56;1-50(2,3)31-18-22-41-36(26-31)37-27-32(51(4,5)6)19-23-42(37)55(41)48-40(54-13)30-46-47(35-16-14-15-17-45(35)57-46)49(48)56-43-24-20-33(52(7,8)9)28-38(43)39-29-34(53(10,11)12)21-25-44(39)56;1-50(2,3)31-18-22-41-36(26-31)37-27-32(51(4,5)6)19-23-42(37)55(41)45-30-40-35-16-14-15-17-46(35)57-49(40)48(47(45)54-13)56-43-24-20-33(52(7,8)9)28-38(43)39-29-34(53(10,11)12)21-25-44(39)56/h20-45H,1-18H3;2*14-34H,1-12H3;3*14-30H,1-12H3
InChIKeyJIFSATNXBRBMLS-UHFFFAOYSA-N
XLogP103.82
TPSA169.09 Ų
H-Bond Donors
H-Bond Acceptors19
Rotatable Bonds16
Heavy Atoms381
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004993.87
LogP ≤ 5103.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1019

Analyze 9-[1,2-bis(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]-3,6-ditert-butylcarbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-2-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole with MolForge

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Related Compounds

3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-4-isocyano-6-phenyldibenzofuran-2-yl]carbazole
CID 155617319
3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-2-isocyanodibenzofuran-3-yl]carbazole
CID 155617335
9-(1-carbazol-9-yl-3-isocyano-6-phenyldibenzofuran-2-yl)carbazole
CID 155617266
3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-6-(2,6-diphenylpyrimidin-4-yl)-3-isocyanodibenzofuran-4-yl]carbazole
CID 155617163
1,4-bis(3,6-ditert-butylcarbazol-9-yl)dibenzofuran-2-carbonitrile;3,4-bis(3,6-ditert-butylcarbazol-9-yl)dibenzofuran-2-carbonitrile;1,3,4-tris(3,6-ditert-butylcarbazol-9-yl)-6-phenyldibenzofuran-2-carbonitrile
CID 157348737
9-[3-(3,6-diphenylcarbazol-9-yl)-2-isocyano-6-phenyldibenzofuran-4-yl]-3,6-diphenylcarbazole
CID 155617223
3,6-ditert-butyl-9-[3-(3,6-ditert-butylcarbazol-9-yl)-6-(2,6-diphenylpyrimidin-4-yl)-2-isocyanodibenzofuran-4-yl]carbazole
CID 155617323
9-(2-carbazol-9-yl-1-isocyano-6-phenyldibenzofuran-3-yl)carbazole
CID 155617209
3,6-ditert-butyl-9-[4-(4-dibenzofuran-1-yl-6-dibenzofuran-2-yl-1,3,5-triazin-2-yl)-2,6-diphenylphenyl]carbazole;3,6-ditert-butyl-9-[4-(4-dibenzofuran-1-yl-6-dibenzofuran-4-yl-1,3,5-triazin-2-yl)-2,6-diphenylphenyl]carbazole;3,6-ditert-butyl-9-[4-(4-dibenzofuran-2-yl-6-dibenzofuran-4-yl-1,3,5-triazin-2-yl)-2,6-diphenylphenyl]carbazole;3,6-ditert-butyl-9-[4-[4,6-di(dibenzofuran-1-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]carbazole;3,6-ditert-butyl-9-[4-[4,6-di(dibenzofuran-2-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]carbazole;3,6-ditert-butyl-9-[4-[4,6-di(dibenzofuran-4-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]carbazole
CID 158060899
3,5-bis(2-tert-butyl-[1]benzofuro[3,2-c]carbazol-5-yl)-4-isocyanobenzonitrile
CID 153462550
9-[1-(3,6-diphenylcarbazol-9-yl)-6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-isocyanodibenzofuran-4-yl]-3,6-diphenylcarbazole
CID 155617159
3,6-ditert-butyl-9-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-2,6-diphenylphenyl]carbazole
CID 146280466

Frequently Asked Questions

What is the IUPAC name of 9-[1,2-bis(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]-3,6-ditert-butylcarbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-2-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole?
The IUPAC name of 9-[1,2-bis(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]-3,6-ditert-butylcarbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-2-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole (CID 158924300) is 9-[1,2-bis(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]-3,6-ditert-butylcarbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-2-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole.
What is the SMILES notation for 9-[1,2-bis(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]-3,6-ditert-butylcarbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-2-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole?
The canonical SMILES for 9-[1,2-bis(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]-3,6-ditert-butylcarbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-2-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole is [C-]#[N+]c1c(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c2c(oc3c(-c4ccccc4)cccc32)c1-n1c2ccc(C(C)(C)C)cc2c2cc(C(C)(C)C)ccc21.[C-]#[N+]c1c(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc2c(oc3c(-c4ccccc4)cccc32)c1-n1c2ccc(C(C)(C)C)cc2c2cc(C(C)(C)C)ccc21.[C-]#[N+]c1c(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc2c(oc3ccccc32)c1-n1c2ccc(C(C)(C)C)cc2c2cc(C(C)(C)C)ccc21.[C-]#[N+]c1cc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c2c(oc3c(-c4ccccc4)cccc32)c1-n1c2ccc(C(C)(C)C)cc2c2cc(C(C)(C)C)ccc21.[C-]#[N+]c1cc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c2c(oc3ccccc32)c1-n1c2ccc(C(C)(C)C)cc2c2cc(C(C)(C)C)ccc21.[C-]#[N+]c1cc2oc3ccccc3c2c(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c1-n1c2ccc(C(C)(C)C)cc2c2cc(C(C)(C)C)ccc21.
What is the InChIKey of 9-[1,2-bis(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]-3,6-ditert-butylcarbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-2-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole?
The InChIKey is JIFSATNXBRBMLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C79H80N4O.2C59H57N3O.3C53H53N3O/c1-74(2,3)47-28-34-61-55(40-47)56-41-48(75(4,5)6)29-35-62(56)81(61)69-67-54-27-23-26-53(46-24-21-20-22-25-46)72(54)84-73(67)71(83-65-38-32-51(78(13,14)15)44-59(65)60-45-52(79(16,17)18)33-39-66(60)83)68(80-19)70(69)82-63-36-30-49(76(7,8)9)42-57(63)58-43-50(77(10,11)12)31-37-64(58)82;1-56(2,3)36-22-26-47-42(30-36)43-31-37(57(4,5)6)23-27-48(43)61(47)51-34-46(60-13)53(55-52(51)41-21-17-20-40(54(41)63-55)35-18-15-14-16-19-35)62-49-28-24-38(58(7,8)9)32-44(49)45-33-39(59(10,11)12)25-29-50(45)62;1-56(2,3)36-22-26-47-42(30-36)43-31-37(57(4,5)6)23-27-48(43)61(47)51-34-46-41-21-17-20-40(35-18-15-14-16-19-35)54(41)63-55(46)53(52(51)60-13)62-49-28-24-38(58(7,8)9)32-44(49)45-33-39(59(10,11)12)25-29-50(45)62;1-50(2,3)31-18-22-41-36(26-31)37-27-32(51(4,5)6)19-23-42(37)55(41)45-30-40(54-13)48(49-47(45)35-16-14-15-17-46(35)57-49)56-43-24-20-33(52(7,8)9)28-38(43)39-29-34(53(10,11)12)21-25-44(39)56;1-50(2,3)31-18-22-41-36(26-31)37-27-32(51(4,5)6)19-23-42(37)55(41)48-40(54-13)30-46-47(35-16-14-15-17-45(35)57-46)49(48)56-43-24-20-33(52(7,8)9)28-38(43)39-29-34(53(10,11)12)21-25-44(39)56;1-50(2,3)31-18-22-41-36(26-31)37-27-32(51(4,5)6)19-23-42(37)55(41)45-30-40-35-16-14-15-17-46(35)57-49(40)48(47(45)54-13)56-43-24-20-33(52(7,8)9)28-38(43)39-29-34(53(10,11)12)21-25-44(39)56/h20-45H,1-18H3;2*14-34H,1-12H3;3*14-30H,1-12H3.
What are the key properties of 9-[1,2-bis(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]-3,6-ditert-butylcarbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-2-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole?
9-[1,2-bis(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]-3,6-ditert-butylcarbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-2-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole has a molecular weight of 4993.87 g/mol, XLogP of 103.82, 16 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[1,2-bis(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]-3,6-ditert-butylcarbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-2-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyanodibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[1-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole;3,6-ditert-butyl-9-[2-(3,6-ditert-butylcarbazol-9-yl)-3-isocyano-6-phenyldibenzofuran-4-yl]carbazole is sourced from PubChem (CID 158924300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).