9,10-dinaphthalen-2-yl-2-phenylanthracene;ethane;3-phenylfluoranthene;9-phenylphenanthrene;1-phenylpyrene;2-phenyltriphenylene;pentakis(yttrium)

C138H114Y5 — CID 159158048

IUPAC9,10-dinaphthalen-2-yl-2-phenylanthracene;ethane;3-phenylfluoranthene;9-phenylphenanthrene;1-phenylpyrene;2-phenyltriphenylene;pentakis(yttrium)
SMILESCC.CC.CC.CC.CC.[Y].[Y].[Y].[Y].[Y].c1ccc(-c2cc3ccccc3c3ccccc23)cc1.c1ccc(-c2ccc3c(-c4ccc5ccccc5c4)c4ccccc4c(-c4ccc5ccccc5c4)c3c2)cc1.c1ccc(-c2ccc3c4c(cccc24)-c2ccccc2-3)cc1.c1ccc(-c2ccc3c4ccccc4c4ccccc4c3c2)cc1.c1ccc(-c2ccc3ccc4cccc5ccc2c3c45)cc1
InChIInChI=1S/C40H26.C24H16.2C22H14.C20H14.5C2H6.5Y/c1-2-10-27(11-3-1)32-22-23-37-38(26-32)40(34-21-19-29-13-5-7-15-31(29)25-34)36-17-9-8-16-35(36)39(37)33-20-18-28-12-4-6-14-30(28)24-33;1-2-8-17(9-3-1)18-14-15-23-21-12-5-4-10-19(21)20-11-6-7-13-22(20)24(23)16-18;1-2-7-15(8-3-1)16-13-14-21-18-10-5-4-9-17(18)20-12-6-11-19(16)22(20)21;1-2-5-15(6-3-1)19-13-11-18-10-9-16-7-4-8-17-12-14-20(19)22(18)21(16)17;1-2-8-15(9-3-1)20-14-16-10-4-5-11-17(16)18-12-6-7-13-19(18)20;5*1-2;;;;;/h1-26H;1-16H;2*1-14H;1-14H;5*1-2H3;;;;;
InChIKeyKKDGPYFBHLWCEU-UHFFFAOYSA-N
MW2216.96 g/mol
LogP41.30
Rot. Bonds7

About 9,10-dinaphthalen-2-yl-2-phenylanthracene;ethane;3-phenylfluoranthene;9-phenylphenanthrene;1-phenylpyrene;2-phenyltriphenylene;pentakis(yttrium)

9,10-dinaphthalen-2-yl-2-phenylanthracene;ethane;3-phenylfluoranthene;9-phenylphenanthrene;1-phenylpyrene;2-phenyltriphenylene;pentakis(yttrium) (PubChem CID 159158048) has the molecular formula C138H114Y5 and a molecular weight of 2216.96 g/mol. Its IUPAC name is 9,10-dinaphthalen-2-yl-2-phenylanthracene;ethane;3-phenylfluoranthene;9-phenylphenanthrene;1-phenylpyrene;2-phenyltriphenylene;pentakis(yttrium).

Molecular Properties

Compound Name9,10-dinaphthalen-2-yl-2-phenylanthracene;ethane;3-phenylfluoranthene;9-phenylphenanthrene;1-phenylpyrene;2-phenyltriphenylene;pentakis(yttrium)
PubChem CID159158048
Molecular FormulaC138H114Y5
Molecular Weight2216.96 g/mol
Exact Mass2215.42
IUPAC Name9,10-dinaphthalen-2-yl-2-phenylanthracene;ethane;3-phenylfluoranthene;9-phenylphenanthrene;1-phenylpyrene;2-phenyltriphenylene;pentakis(yttrium)
SMILESCC.CC.CC.CC.CC.[Y].[Y].[Y].[Y].[Y].c1ccc(-c2cc3ccccc3c3ccccc23)cc1.c1ccc(-c2ccc3c(-c4ccc5ccccc5c4)c4ccccc4c(-c4ccc5ccccc5c4)c3c2)cc1.c1ccc(-c2ccc3c4c(cccc24)-c2ccccc2-3)cc1.c1ccc(-c2ccc3c4ccccc4c4ccccc4c3c2)cc1.c1ccc(-c2ccc3ccc4cccc5ccc2c3c45)cc1
InChIInChI=1S/C40H26.C24H16.2C22H14.C20H14.5C2H6.5Y/c1-2-10-27(11-3-1)32-22-23-37-38(26-32)40(34-21-19-29-13-5-7-15-31(29)25-34)36-17-9-8-16-35(36)39(37)33-20-18-28-12-4-6-14-30(28)24-33;1-2-8-17(9-3-1)18-14-15-23-21-12-5-4-10-19(21)20-11-6-7-13-22(20)24(23)16-18;1-2-7-15(8-3-1)16-13-14-21-18-10-5-4-9-17(18)20-12-6-11-19(16)22(20)21;1-2-5-15(6-3-1)19-13-11-18-10-9-16-7-4-8-17-12-14-20(19)22(18)21(16)17;1-2-8-15(9-3-1)20-14-16-10-4-5-11-17(16)18-12-6-7-13-19(18)20;5*1-2;;;;;/h1-26H;1-16H;2*1-14H;1-14H;5*1-2H3;;;;;
InChIKeyKKDGPYFBHLWCEU-UHFFFAOYSA-N
XLogP41.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms143
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002216.96
LogP ≤ 541.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 9,10-dinaphthalen-2-yl-2-phenylanthracene;ethane;3-phenylfluoranthene;9-phenylphenanthrene;1-phenylpyrene;2-phenyltriphenylene;pentakis(yttrium) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9,10-dinaphthalen-1-yl-2-phenanthren-9-ylanthracene;9,10-dinaphthalen-2-yl-2-phenanthren-9-ylanthracene;2-phenanthren-9-yl-9,10-diphenylanthracene;1-(2-phenanthren-9-yl-10-pyren-1-ylanthracen-9-yl)pyrene
CID 160675826
9,10-dinaphthalen-1-yl-2-naphthalen-2-ylanthracene;2-naphthalen-2-yl-9,10-diphenylanthracene;2-(3-naphthalen-1-yl-10-pyren-1-ylanthracen-9-yl)triphenylene;2,9,10-trinaphthalen-2-ylanthracene
CID 159027158
3-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]fluoranthene;9-naphthalen-2-yl-10-(4-naphthalen-1-ylphenyl)anthracene;9-naphthalen-2-yl-10-(4-phenanthren-9-ylphenyl)anthracene;9-naphthalen-2-yl-10-[2-(4-phenylphenyl)phenyl]anthracene;9-phenanthren-9-yl-10-(2-phenylphenyl)anthracene
CID 162263173
9-(3-phenanthren-9-ylphenyl)-10-(3-phenylphenyl)anthracene;9-(4-phenanthren-9-ylphenyl)-10-(3-phenylphenyl)anthracene;1-[2-[10-(3-phenylphenyl)anthracen-9-yl]phenyl]pyrene
CID 165031655
9-(6,8-diphenylnaphthalen-2-yl)-10-(4-phenylnaphthalen-1-yl)anthracene;1-methyl-9-[6-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]naphthalen-2-yl]phenanthrene;1-(10-naphthalen-2-ylanthracen-9-yl)pyrene;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene;9-(6-naphthalen-1-ylnaphthalen-2-yl)-10-(6-phenylnaphthalen-2-yl)anthracene;9-(6-phenanthren-9-ylnaphthalen-2-yl)-10-(6-phenylnaphthalen-2-yl)anthracene
CID 158514658
1,6-bis(4-naphthalen-2-ylphenyl)pyrene;5,12-diphenylheptacyclo[14.11.1.02,15.04,13.06,11.018,23.024,28]octacosa-1(27),2,4,6,8,10,12,14,16,18,20,22,24(28),25-tetradecaene;15,26-diphenylhexacyclo[12.12.0.02,7.08,13.016,25.018,23]hexacosa-1(26),2,4,6,8,10,12,14,16,18,20,22,24-tridecaene;5,12-diphenylhexacyclo[14.7.1.02,15.04,13.06,11.020,24]tetracosa-1(23),2,4,6,8,10,12,14,16,18,20(24),21-dodecaene;3-[6-(3,5-diphenylphenyl)naphthalen-2-yl]perylene;3-(7-fluoranthen-3-ylphenanthren-2-yl)fluoranthene;methane;3-(6-naphthalen-2-ylnaphthalen-2-yl)perylene
CID 158715295
3-(10-phenanthren-9-yl-2-phenylanthracen-9-yl)fluoranthene
CID 58323659
3-[4-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]-10-phenylphenanthrene
CID 58194539
3-[4-(10-fluoranthen-3-ylanthracen-9-yl)phenyl]fluoranthene;2-[10-fluoranthen-3-yl-9-(4-naphthalen-1-ylphenyl)anthracen-2-yl]pyridine;2-methyl-10-phenanthren-1-yl-9-(4-phenanthren-9-ylphenyl)anthracene;3-[4-(10-naphthalen-2-yl-2,6-diphenylanthracen-9-yl)phenyl]fluoranthene;9-naphthalen-2-yl-2,6-diphenyl-10-(3-phenylphenyl)anthracene;9-naphthalen-2-yl-10-(4-naphthalen-1-ylphenyl)-2,6-diphenylanthracene
CID 160841400
2-(3-naphthalen-1-yl-10-naphthalen-2-ylanthracen-9-yl)triphenylene;2-naphthalen-1-yl-10-naphthalen-2-yl-9-(4-naphthalen-1-ylphenyl)anthracene;2-naphthalen-1-yl-10-naphthalen-2-yl-9-(2-phenanthren-9-ylphenyl)anthracene;2-naphthalen-1-yl-10-naphthalen-2-yl-9-(3-phenylphenyl)anthracene
CID 159987289
1-(3-naphthalen-1-ylphenyl)-5-(4-naphthalen-1-ylphenyl)naphthalene;1-(3-naphthalen-2-ylphenyl)-5-(4-naphthalen-1-ylphenyl)naphthalene;9-[4-[4-(3-naphthalen-1-ylphenyl)naphthalen-1-yl]phenyl]phenanthrene;9-[4-[4-(4-naphthalen-1-ylphenyl)naphthalen-1-yl]phenyl]phenanthrene;9-[4-[5-(3-naphthalen-1-ylphenyl)naphthalen-1-yl]phenyl]phenanthrene;9-[4-[5-(4-naphthalen-1-ylphenyl)naphthalen-1-yl]phenyl]phenanthrene;9-[4-[6-(3-naphthalen-1-ylphenyl)naphthalen-2-yl]phenyl]phenanthrene;9-[4-[6-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]phenyl]phenanthrene;2-[4-[6-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]phenyl]triphenylene;1-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)naphthalene;1-(4-naphthalen-2-ylphenyl)-5-(4-phenylphenyl)naphthalene;2-(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)naphthalene
CID 159867264
7-(6-phenylpyren-2-yl)benzo[a]anthracene
CID 177078612

Frequently Asked Questions

What is the IUPAC name of 9,10-dinaphthalen-2-yl-2-phenylanthracene;ethane;3-phenylfluoranthene;9-phenylphenanthrene;1-phenylpyrene;2-phenyltriphenylene;pentakis(yttrium)?
The IUPAC name of 9,10-dinaphthalen-2-yl-2-phenylanthracene;ethane;3-phenylfluoranthene;9-phenylphenanthrene;1-phenylpyrene;2-phenyltriphenylene;pentakis(yttrium) (CID 159158048) is 9,10-dinaphthalen-2-yl-2-phenylanthracene;ethane;3-phenylfluoranthene;9-phenylphenanthrene;1-phenylpyrene;2-phenyltriphenylene;pentakis(yttrium).
What is the SMILES notation for 9,10-dinaphthalen-2-yl-2-phenylanthracene;ethane;3-phenylfluoranthene;9-phenylphenanthrene;1-phenylpyrene;2-phenyltriphenylene;pentakis(yttrium)?
The canonical SMILES for 9,10-dinaphthalen-2-yl-2-phenylanthracene;ethane;3-phenylfluoranthene;9-phenylphenanthrene;1-phenylpyrene;2-phenyltriphenylene;pentakis(yttrium) is CC.CC.CC.CC.CC.[Y].[Y].[Y].[Y].[Y].c1ccc(-c2cc3ccccc3c3ccccc23)cc1.c1ccc(-c2ccc3c(-c4ccc5ccccc5c4)c4ccccc4c(-c4ccc5ccccc5c4)c3c2)cc1.c1ccc(-c2ccc3c4c(cccc24)-c2ccccc2-3)cc1.c1ccc(-c2ccc3c4ccccc4c4ccccc4c3c2)cc1.c1ccc(-c2ccc3ccc4cccc5ccc2c3c45)cc1.
What is the InChIKey of 9,10-dinaphthalen-2-yl-2-phenylanthracene;ethane;3-phenylfluoranthene;9-phenylphenanthrene;1-phenylpyrene;2-phenyltriphenylene;pentakis(yttrium)?
The InChIKey is KKDGPYFBHLWCEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H26.C24H16.2C22H14.C20H14.5C2H6.5Y/c1-2-10-27(11-3-1)32-22-23-37-38(26-32)40(34-21-19-29-13-5-7-15-31(29)25-34)36-17-9-8-16-35(36)39(37)33-20-18-28-12-4-6-14-30(28)24-33;1-2-8-17(9-3-1)18-14-15-23-21-12-5-4-10-19(21)20-11-6-7-13-22(20)24(23)16-18;1-2-7-15(8-3-1)16-13-14-21-18-10-5-4-9-17(18)20-12-6-11-19(16)22(20)21;1-2-5-15(6-3-1)19-13-11-18-10-9-16-7-4-8-17-12-14-20(19)22(18)21(16)17;1-2-8-15(9-3-1)20-14-16-10-4-5-11-17(16)18-12-6-7-13-19(18)20;5*1-2;;;;;/h1-26H;1-16H;2*1-14H;1-14H;5*1-2H3;;;;;.
What are the key properties of 9,10-dinaphthalen-2-yl-2-phenylanthracene;ethane;3-phenylfluoranthene;9-phenylphenanthrene;1-phenylpyrene;2-phenyltriphenylene;pentakis(yttrium)?
9,10-dinaphthalen-2-yl-2-phenylanthracene;ethane;3-phenylfluoranthene;9-phenylphenanthrene;1-phenylpyrene;2-phenyltriphenylene;pentakis(yttrium) has a molecular weight of 2216.96 g/mol, XLogP of 41.30, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,10-dinaphthalen-2-yl-2-phenylanthracene;ethane;3-phenylfluoranthene;9-phenylphenanthrene;1-phenylpyrene;2-phenyltriphenylene;pentakis(yttrium) is sourced from PubChem (CID 159158048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).