[6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-methyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole

C172H114F36N12Si2 — CID 158206310

IUPAC[6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-methyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole
SMILESCC(C)(C)c1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc(C(C)(C)C)cn3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)nc1.C[Si](C)(C)c1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc([Si](C)(C)C)cn3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)nc1.Cc1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc(C)cn3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)nc1
InChIInChI=1S/C60H42F12N4.C58H42F12N4Si2.C54H30F12N4/c1-55(2,3)35-7-17-47(73-29-35)53-39-15-13-38(76-51-21-11-33(59(67,68)69)25-43(51)44-26-34(60(70,71)72)12-22-52(44)76)28-46(39)54(48-18-8-36(30-74-48)56(4,5)6)40-16-14-37(27-45(40)53)75-49-19-9-31(57(61,62)63)23-41(49)42-24-32(58(64,65)66)10-20-50(42)75;1-75(2,3)37-13-17-47(71-29-37)53-39-15-11-36(74-51-21-9-33(57(65,66)67)25-43(51)44-26-34(58(68,69)70)10-22-52(44)74)28-46(39)54(48-18-14-38(30-72-48)76(4,5)6)40-16-12-35(27-45(40)53)73-49-19-7-31(55(59,60)61)23-41(49)42-24-32(56(62,63)64)8-20-50(42)73;1-27-3-13-43(67-25-27)49-35-11-9-34(70-47-17-7-31(53(61,62)63)21-39(47)40-22-32(54(64,65)66)8-18-48(40)70)24-42(35)50(44-14-4-28(2)26-68-44)36-12-10-33(23-41(36)49)69-45-15-5-29(51(55,56)57)19-37(45)38-20-30(52(58,59)60)6-16-46(38)69/h2*7-30H,1-6H3;3-26H,1-2H3
InChIKeyGBNPIBJCOGMJAF-UHFFFAOYSA-N
MW3088.99 g/mol
LogP53.46
Rot. Bonds14

About [6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-methyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole

[6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-methyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole (PubChem CID 158206310) has the molecular formula C172H114F36N12Si2 and a molecular weight of 3088.99 g/mol. Its IUPAC name is [6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-methyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole.

Molecular Properties

Compound Name[6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-methyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole
PubChem CID158206310
Molecular FormulaC172H114F36N12Si2
Molecular Weight3088.99 g/mol
Exact Mass3086.83
IUPAC Name[6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-methyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole
SMILESCC(C)(C)c1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc(C(C)(C)C)cn3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)nc1.C[Si](C)(C)c1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc([Si](C)(C)C)cn3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)nc1.Cc1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc(C)cn3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)nc1
InChIInChI=1S/C60H42F12N4.C58H42F12N4Si2.C54H30F12N4/c1-55(2,3)35-7-17-47(73-29-35)53-39-15-13-38(76-51-21-11-33(59(67,68)69)25-43(51)44-26-34(60(70,71)72)12-22-52(44)76)28-46(39)54(48-18-8-36(30-74-48)56(4,5)6)40-16-14-37(27-45(40)53)75-49-19-9-31(57(61,62)63)23-41(49)42-24-32(58(64,65)66)10-20-50(42)75;1-75(2,3)37-13-17-47(71-29-37)53-39-15-11-36(74-51-21-9-33(57(65,66)67)25-43(51)44-26-34(58(68,69)70)10-22-52(44)74)28-46(39)54(48-18-14-38(30-72-48)76(4,5)6)40-16-12-35(27-45(40)53)73-49-19-7-31(55(59,60)61)23-41(49)42-24-32(56(62,63)64)8-20-50(42)73;1-27-3-13-43(67-25-27)49-35-11-9-34(70-47-17-7-31(53(61,62)63)21-39(47)40-22-32(54(64,65)66)8-18-48(40)70)24-42(35)50(44-14-4-28(2)26-68-44)36-12-10-33(23-41(36)49)69-45-15-5-29(51(55,56)57)19-37(45)38-20-30(52(58,59)60)6-16-46(38)69/h2*7-30H,1-6H3;3-26H,1-2H3
InChIKeyGBNPIBJCOGMJAF-UHFFFAOYSA-N
XLogP53.46
TPSA106.92 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds14
Heavy Atoms222
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003088.99
LogP ≤ 553.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze [6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-methyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole with MolForge

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Related Compounds

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CID 16683885
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Ru(II)(phen)2(phen-cyclam-Fe(III))
CID 16683887
Ru(II)(phen)2(phen-cyclam-Co(III)-Cl2)
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9-[6-[3,6-Bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-pyridin-2-ylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole
CID 59357111
[6-[2,6-Bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilylpyridin-2-yl)anthracen-9-yl]pyridin-3-yl]-trimethylsilane
CID 59357121
9-[6-[3,6-Bis(trifluoromethyl)carbazol-9-yl]-9,10-di(isoquinolin-1-yl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole
CID 59357140
9-[6-[3,6-Bis(trifluoromethyl)carbazol-9-yl]-9,10-dipyridin-3-ylanthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole
CID 59357152
9-[6-(3,6-Difluorocarbazol-9-yl)-9,10-bis(4-pyridin-2-ylphenyl)anthracen-2-yl]-3,6-difluorocarbazole
CID 59357159
9-[6-(3,6-Difluorocarbazol-9-yl)-9,10-dipyridin-3-ylanthracen-2-yl]-3,6-difluorocarbazole
CID 59357166
9-[6-[3,6-Bis(trifluoromethyl)carbazol-9-yl]-9,10-dipyridin-2-ylanthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole
CID 59357167
9-[6-(3,6-Difluorocarbazol-9-yl)-9,10-dipyridin-2-ylanthracen-2-yl]-3,6-difluorocarbazole
CID 59357172

Frequently Asked Questions

What is the IUPAC name of [6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-methyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole?
The IUPAC name of [6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-methyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole (CID 158206310) is [6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-methyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole.
What is the SMILES notation for [6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-methyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole?
The canonical SMILES for [6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-methyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole is CC(C)(C)c1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc(C(C)(C)C)cn3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)nc1.C[Si](C)(C)c1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc([Si](C)(C)C)cn3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)nc1.Cc1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc(C)cn3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)nc1.
What is the InChIKey of [6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-methyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole?
The InChIKey is GBNPIBJCOGMJAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H42F12N4.C58H42F12N4Si2.C54H30F12N4/c1-55(2,3)35-7-17-47(73-29-35)53-39-15-13-38(76-51-21-11-33(59(67,68)69)25-43(51)44-26-34(60(70,71)72)12-22-52(44)76)28-46(39)54(48-18-8-36(30-74-48)56(4,5)6)40-16-14-37(27-45(40)53)75-49-19-9-31(57(61,62)63)23-41(49)42-24-32(58(64,65)66)10-20-50(42)75;1-75(2,3)37-13-17-47(71-29-37)53-39-15-11-36(74-51-21-9-33(57(65,66)67)25-43(51)44-26-34(58(68,69)70)10-22-52(44)74)28-46(39)54(48-18-14-38(30-72-48)76(4,5)6)40-16-12-35(27-45(40)53)73-49-19-7-31(55(59,60)61)23-41(49)42-24-32(56(62,63)64)8-20-50(42)73;1-27-3-13-43(67-25-27)49-35-11-9-34(70-47-17-7-31(53(61,62)63)21-39(47)40-22-32(54(64,65)66)8-18-48(40)70)24-42(35)50(44-14-4-28(2)26-68-44)36-12-10-33(23-41(36)49)69-45-15-5-29(51(55,56)57)19-37(45)38-20-30(52(58,59)60)6-16-46(38)69/h2*7-30H,1-6H3;3-26H,1-2H3.
What are the key properties of [6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-methyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole?
[6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-methyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole has a molecular weight of 3088.99 g/mol, XLogP of 53.46, 14 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-methyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole is sourced from PubChem (CID 158206310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).