9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-dipyridin-2-ylanthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole

C130H70F24N6 — CID 159763580

IUPAC9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-dipyridin-2-ylanthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole
SMILESFC(F)(F)c1ccc2c(c1)c1cc(C(F)(F)F)ccc1n2-c1ccc2c(-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c3cc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)ccc3c(-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c2c1.FC(F)(F)c1ccc2c(c1)c1cc(C(F)(F)F)ccc1n2-c1ccc2c(-c3ccccn3)c3cc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)ccc3c(-c3ccccn3)c2c1
InChIInChI=1S/C78H44F12N2.C52H26F12N4/c79-75(80,81)55-21-29-69-63(39-55)64-40-56(76(82,83)84)22-30-70(64)91(69)59-26-28-62-67(43-59)73(53-35-49(45-13-5-1-6-14-45)33-50(36-53)46-15-7-2-8-16-46)61-27-25-60(92-71-31-23-57(77(85,86)87)41-65(71)66-42-58(78(88,89)90)24-32-72(66)92)44-68(61)74(62)54-37-51(47-17-9-3-10-18-47)34-52(38-54)48-19-11-4-12-20-48;53-49(54,55)27-7-15-43-35(21-27)36-22-28(50(56,57)58)8-16-44(36)67(43)31-12-14-34-39(25-31)47(41-5-1-3-19-65-41)33-13-11-32(26-40(33)48(34)42-6-2-4-20-66-42)68-45-17-9-29(51(59,60)61)23-37(45)38-24-30(52(62,63)64)10-18-46(38)68/h1-44H;1-26H
InChIKeyNFFDHFRCAQGZFT-UHFFFAOYSA-N
MW2171.98 g/mol
LogP40.65
Rot. Bonds12

About 9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-dipyridin-2-ylanthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole

9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-dipyridin-2-ylanthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole (PubChem CID 159763580) has the molecular formula C130H70F24N6 and a molecular weight of 2171.98 g/mol. Its IUPAC name is 9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-dipyridin-2-ylanthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole.

Molecular Properties

Compound Name9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-dipyridin-2-ylanthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole
PubChem CID159763580
Molecular FormulaC130H70F24N6
Molecular Weight2171.98 g/mol
Exact Mass2170.53
IUPAC Name9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-dipyridin-2-ylanthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole
SMILESFC(F)(F)c1ccc2c(c1)c1cc(C(F)(F)F)ccc1n2-c1ccc2c(-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c3cc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)ccc3c(-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c2c1.FC(F)(F)c1ccc2c(c1)c1cc(C(F)(F)F)ccc1n2-c1ccc2c(-c3ccccn3)c3cc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)ccc3c(-c3ccccn3)c2c1
InChIInChI=1S/C78H44F12N2.C52H26F12N4/c79-75(80,81)55-21-29-69-63(39-55)64-40-56(76(82,83)84)22-30-70(64)91(69)59-26-28-62-67(43-59)73(53-35-49(45-13-5-1-6-14-45)33-50(36-53)46-15-7-2-8-16-46)61-27-25-60(92-71-31-23-57(77(85,86)87)41-65(71)66-42-58(78(88,89)90)24-32-72(66)92)44-68(61)74(62)54-37-51(47-17-9-3-10-18-47)34-52(38-54)48-19-11-4-12-20-48;53-49(54,55)27-7-15-43-35(21-27)36-22-28(50(56,57)58)8-16-44(36)67(43)31-12-14-34-39(25-31)47(41-5-1-3-19-65-41)33-13-11-32(26-40(33)48(34)42-6-2-4-20-66-42)68-45-17-9-29(51(59,60)61)23-37(45)38-24-30(52(62,63)64)10-18-46(38)68/h1-44H;1-26H
InChIKeyNFFDHFRCAQGZFT-UHFFFAOYSA-N
XLogP40.65
TPSA45.50 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms160
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002171.98
LogP ≤ 540.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-dipyridin-2-ylanthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole with MolForge

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Related Compounds

2-(1-Benzylindol-6-yl)-5,10-dimethylphenanthridin-5-ium chloride
CID 164624791
5,10-Dimethyl-2-[1-(3-propylphenyl)indol-6-yl]phenanthridin-5-ium chloride
CID 164611513
5,9-Dimethyl-2-[1-[3-(3-methylbutyl)phenyl]indol-6-yl]phenanthridin-5-ium chloride
CID 164612817
5,10-Dimethyl-2-[1-[[4-(trifluoromethyl)phenyl]methyl]indol-6-yl]phenanthridin-5-ium chloride
CID 164615976
5,9-Dimethyl-2-[1-(3-propylphenyl)indol-6-yl]phenanthridin-5-ium chloride
CID 164618343
5,9-Dimethyl-2-[1-[[4-(trifluoromethyl)phenyl]methyl]indol-6-yl]phenanthridin-5-ium chloride
CID 164624059
2-(1-Benzylindol-6-yl)-5,9-dimethylphenanthridin-5-ium chloride
CID 164625709
5,10-Dimethyl-2-[1-[3-(3-methylbutyl)phenyl]indol-6-yl]phenanthridin-5-ium chloride
CID 164628151
1-[[2-(Trifluoromethyl)phenyl]methyl]-6-[1-[[2-(trifluoromethyl)phenyl]methyl]indol-6-yl]indole
CID 56851723
6-Benzyl-5,11-dimethyl-6H-pyrido[4,3-B]carbazole
CID 331284
5,11-Dioctyl-2,8-bis[4-(trifluoromethyl)phenyl]indolo[3,2-b]carbazole
CID 102033935
4-carbazol-9-yl-2-methyl-N-[4-(2-methylcarbazol-9-yl)phenyl]-N-[4-[3-(trifluoromethyl)carbazol-9-yl]phenyl]aniline
CID 138984975

Frequently Asked Questions

What is the IUPAC name of 9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-dipyridin-2-ylanthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole?
The IUPAC name of 9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-dipyridin-2-ylanthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole (CID 159763580) is 9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-dipyridin-2-ylanthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole.
What is the SMILES notation for 9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-dipyridin-2-ylanthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole?
The canonical SMILES for 9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-dipyridin-2-ylanthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole is FC(F)(F)c1ccc2c(c1)c1cc(C(F)(F)F)ccc1n2-c1ccc2c(-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c3cc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)ccc3c(-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c2c1.FC(F)(F)c1ccc2c(c1)c1cc(C(F)(F)F)ccc1n2-c1ccc2c(-c3ccccn3)c3cc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)ccc3c(-c3ccccn3)c2c1.
What is the InChIKey of 9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-dipyridin-2-ylanthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole?
The InChIKey is NFFDHFRCAQGZFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C78H44F12N2.C52H26F12N4/c79-75(80,81)55-21-29-69-63(39-55)64-40-56(76(82,83)84)22-30-70(64)91(69)59-26-28-62-67(43-59)73(53-35-49(45-13-5-1-6-14-45)33-50(36-53)46-15-7-2-8-16-46)61-27-25-60(92-71-31-23-57(77(85,86)87)41-65(71)66-42-58(78(88,89)90)24-32-72(66)92)44-68(61)74(62)54-37-51(47-17-9-3-10-18-47)34-52(38-54)48-19-11-4-12-20-48;53-49(54,55)27-7-15-43-35(21-27)36-22-28(50(56,57)58)8-16-44(36)67(43)31-12-14-34-39(25-31)47(41-5-1-3-19-65-41)33-13-11-32(26-40(33)48(34)42-6-2-4-20-66-42)68-45-17-9-29(51(59,60)61)23-37(45)38-24-30(52(62,63)64)10-18-46(38)68/h1-44H;1-26H.
What are the key properties of 9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-dipyridin-2-ylanthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole?
9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-dipyridin-2-ylanthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole has a molecular weight of 2171.98 g/mol, XLogP of 40.65, 12 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-dipyridin-2-ylanthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole is sourced from PubChem (CID 159763580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).