9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;tri(quinolin-8-yloxy)alumane

C133H94AlN9O3 — CID 158109300

IUPAC9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;tri(quinolin-8-yloxy)alumane
SMILESCc1cc(-c2ccccc2)c2ccc3c(-c4ccccc4)cc(C)nc3c2n1.c1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)c2cccc3ccccc23)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.c1cnc2c(O[Al](Oc3cccc4cccnc34)Oc3cccc4cccnc34)cccc2c1
InChIInChI=1S/C44H32N2.C36H24N2.C26H20N2.3C9H7NO.Al/c1-3-17-37(18-4-1)45(43-23-11-15-35-13-7-9-21-41(35)43)39-29-25-33(26-30-39)34-27-31-40(32-28-34)46(38-19-5-2-6-20-38)44-24-12-16-36-14-8-10-22-42(36)44;1-5-13-33-29(9-1)30-10-2-6-14-34(30)37(33)27-21-17-25(18-22-27)26-19-23-28(24-20-26)38-35-15-7-3-11-31(35)32-12-4-8-16-36(32)38;1-17-15-23(19-9-5-3-6-10-19)21-13-14-22-24(20-11-7-4-8-12-20)16-18(2)28-26(22)25(21)27-17;3*11-8-5-1-3-7-4-2-6-10-9(7)8;/h1-32H;1-24H;3-16H,1-2H3;3*1-6,11H;/q;;;;;;+3/p-3
InChIKeyFQFNRQWOYWBQMS-UHFFFAOYSA-K
MW1893.26 g/mol
LogP34.73
Rot. Bonds18

About 9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;tri(quinolin-8-yloxy)alumane

9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;tri(quinolin-8-yloxy)alumane (PubChem CID 158109300) has the molecular formula C133H94AlN9O3 and a molecular weight of 1893.26 g/mol. Its IUPAC name is 9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;tri(quinolin-8-yloxy)alumane.

Molecular Properties

Compound Name9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;tri(quinolin-8-yloxy)alumane
PubChem CID158109300
Molecular FormulaC133H94AlN9O3
Molecular Weight1893.26 g/mol
Exact Mass1891.73
IUPAC Name9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;tri(quinolin-8-yloxy)alumane
SMILESCc1cc(-c2ccccc2)c2ccc3c(-c4ccccc4)cc(C)nc3c2n1.c1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)c2cccc3ccccc23)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.c1cnc2c(O[Al](Oc3cccc4cccnc34)Oc3cccc4cccnc34)cccc2c1
InChIInChI=1S/C44H32N2.C36H24N2.C26H20N2.3C9H7NO.Al/c1-3-17-37(18-4-1)45(43-23-11-15-35-13-7-9-21-41(35)43)39-29-25-33(26-30-39)34-27-31-40(32-28-34)46(38-19-5-2-6-20-38)44-24-12-16-36-14-8-10-22-42(36)44;1-5-13-33-29(9-1)30-10-2-6-14-34(30)37(33)27-21-17-25(18-22-27)26-19-23-28(24-20-26)38-35-15-7-3-11-31(35)32-12-4-8-16-36(32)38;1-17-15-23(19-9-5-3-6-10-19)21-13-14-22-24(20-11-7-4-8-12-20)16-18(2)28-26(22)25(21)27-17;3*11-8-5-1-3-7-4-2-6-10-9(7)8;/h1-32H;1-24H;3-16H,1-2H3;3*1-6,11H;/q;;;;;;+3/p-3
InChIKeyFQFNRQWOYWBQMS-UHFFFAOYSA-K
XLogP34.73
TPSA108.48 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds18
Heavy Atoms146
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001893.26
LogP ≤ 534.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;tri(quinolin-8-yloxy)alumane with MolForge

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Related Compounds

Tetrakis(quinolin-8-olate);zirconium(4+)
CID 139195714
CID 157251634
CID 157251634
4-N,4-N-bis[2,5-dimethyl-4-(N-(3-methylphenyl)anilino)phenyl]-2,5-dimethyl-1-N-(3-methylphenyl)-1-N-phenylbenzene-1,4-diamine;1-[4,6-bis[2-(trifluoromethyl)benzimidazol-1-yl]-1,3,5-triazin-2-yl]-2-(trifluoromethyl)benzimidazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;tri(quinolin-8-yloxy)alumane
CID 158788116
CID 159204676
CID 159204676
Tricopper;hexakis(5,7-dimethylquinolin-8-olate)
CID 139040557
Tetrakis(quinolin-8-olato-kappa^2^N,O)hafnium(IV) toluene disolvate
CID 139077805
Tetrakis(5,7-dimethylquinolin-8-olato-kappa^2^N,O)hafnium(IV) dimethylformamide disolvate
CID 139082165
cyclo-Tetrakis{mu-N'-[(8-oxidoquinolin-7-yl)methylidene]isonicotinohydrazidato}tetrazinc tetrahydrate
CID 139083911
Tetrakis(cobalt(2+));octakis(quinolin-8-olate)
CID 139198080
Disodium;tetrakis(cobalt(2+));tetrakis(7-[1-(8-oxidoquinolin-7-yl)ethyl]quinolin-8-olate);bis(quinolin-8-olate)
CID 139198081
Bis(1-[(4-methyl-2-oxidophenyl)diazenyl]naphthalen-2-olate);bis(oxygen(2-));bis(2-pyridin-2-ylpyridine);bis(vanadium(4+))
CID 168349378
Tris(benzo[f]quinolin-5-yloxy)alumane
CID 20608027

Frequently Asked Questions

What is the IUPAC name of 9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;tri(quinolin-8-yloxy)alumane?
The IUPAC name of 9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;tri(quinolin-8-yloxy)alumane (CID 158109300) is 9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;tri(quinolin-8-yloxy)alumane.
What is the SMILES notation for 9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;tri(quinolin-8-yloxy)alumane?
The canonical SMILES for 9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;tri(quinolin-8-yloxy)alumane is Cc1cc(-c2ccccc2)c2ccc3c(-c4ccccc4)cc(C)nc3c2n1.c1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)c2cccc3ccccc23)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.c1cnc2c(O[Al](Oc3cccc4cccnc34)Oc3cccc4cccnc34)cccc2c1.
What is the InChIKey of 9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;tri(quinolin-8-yloxy)alumane?
The InChIKey is FQFNRQWOYWBQMS-UHFFFAOYSA-K. The full InChI is InChI=1S/C44H32N2.C36H24N2.C26H20N2.3C9H7NO.Al/c1-3-17-37(18-4-1)45(43-23-11-15-35-13-7-9-21-41(35)43)39-29-25-33(26-30-39)34-27-31-40(32-28-34)46(38-19-5-2-6-20-38)44-24-12-16-36-14-8-10-22-42(36)44;1-5-13-33-29(9-1)30-10-2-6-14-34(30)37(33)27-21-17-25(18-22-27)26-19-23-28(24-20-26)38-35-15-7-3-11-31(35)32-12-4-8-16-36(32)38;1-17-15-23(19-9-5-3-6-10-19)21-13-14-22-24(20-11-7-4-8-12-20)16-18(2)28-26(22)25(21)27-17;3*11-8-5-1-3-7-4-2-6-10-9(7)8;/h1-32H;1-24H;3-16H,1-2H3;3*1-6,11H;/q;;;;;;+3/p-3.
What are the key properties of 9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;tri(quinolin-8-yloxy)alumane?
9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;tri(quinolin-8-yloxy)alumane has a molecular weight of 1893.26 g/mol, XLogP of 34.73, 18 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;tri(quinolin-8-yloxy)alumane is sourced from PubChem (CID 158109300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).