9-naphthalen-2-yl-10-phenanthren-2-yl-2,6-diphenylanthracene;9-naphthalen-1-yl-10-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-1-yl-9-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-2-yl-9-phenanthren-2-yl-2-phenylanthracene

C182H116 — CID 161355195

IUPAC9-naphthalen-2-yl-10-phenanthren-2-yl-2,6-diphenylanthracene;9-naphthalen-1-yl-10-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-1-yl-9-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-2-yl-9-phenanthren-2-yl-2-phenylanthracene
SMILESc1ccc(-c2ccc3c(-c4ccc5c(ccc6ccccc65)c4)c4cc(-c5ccccc5)ccc4c(-c4ccc5ccccc5c4)c3c2)cc1.c1ccc(-c2ccc3c(-c4ccc5ccc6ccccc6c5c4)c4ccccc4c(-c4cccc5ccccc45)c3c2)cc1.c1ccc(-c2ccc3c(-c4ccc5ccccc5c4)c4ccccc4c(-c4ccc5c(ccc6ccccc65)c4)c3c2)cc1.c1ccc(-c2ccc3c(-c4cccc5ccccc45)c4ccccc4c(-c4ccc5ccc6ccccc6c5c4)c3c2)cc1
InChIInChI=1S/C50H32.3C44H28/c1-3-11-33(12-4-1)38-24-28-46-47(31-38)49(41-22-19-35-15-7-8-17-37(35)29-41)45-27-23-39(34-13-5-2-6-14-34)32-48(45)50(46)42-25-26-44-40(30-42)21-20-36-16-9-10-18-43(36)44;1-2-11-29(12-3-1)33-25-26-40-42(27-33)43(34-24-23-32-22-21-31-14-5-7-17-36(31)41(32)28-34)38-18-8-9-19-39(38)44(40)37-20-10-15-30-13-4-6-16-35(30)37;1-2-11-29(12-3-1)33-25-26-40-42(27-33)44(37-20-10-15-30-13-4-6-16-35(30)37)39-19-9-8-18-38(39)43(40)34-24-23-32-22-21-31-14-5-7-17-36(31)41(32)28-34;1-2-10-29(11-3-1)33-22-25-41-42(28-33)44(36-23-24-38-34(27-36)20-19-31-13-6-7-15-37(31)38)40-17-9-8-16-39(40)43(41)35-21-18-30-12-4-5-14-32(30)26-35/h1-32H;3*1-28H
InChIKeyVOLHNHDFHTZUEV-UHFFFAOYSA-N
MW2302.93 g/mol
LogP51.48
Rot. Bonds13

About 9-naphthalen-2-yl-10-phenanthren-2-yl-2,6-diphenylanthracene;9-naphthalen-1-yl-10-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-1-yl-9-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-2-yl-9-phenanthren-2-yl-2-phenylanthracene

9-naphthalen-2-yl-10-phenanthren-2-yl-2,6-diphenylanthracene;9-naphthalen-1-yl-10-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-1-yl-9-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-2-yl-9-phenanthren-2-yl-2-phenylanthracene (PubChem CID 161355195) has the molecular formula C182H116 and a molecular weight of 2302.93 g/mol. Its IUPAC name is 9-naphthalen-2-yl-10-phenanthren-2-yl-2,6-diphenylanthracene;9-naphthalen-1-yl-10-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-1-yl-9-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-2-yl-9-phenanthren-2-yl-2-phenylanthracene.

Molecular Properties

Compound Name9-naphthalen-2-yl-10-phenanthren-2-yl-2,6-diphenylanthracene;9-naphthalen-1-yl-10-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-1-yl-9-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-2-yl-9-phenanthren-2-yl-2-phenylanthracene
PubChem CID161355195
Molecular FormulaC182H116
Molecular Weight2302.93 g/mol
Exact Mass2300.91
IUPAC Name9-naphthalen-2-yl-10-phenanthren-2-yl-2,6-diphenylanthracene;9-naphthalen-1-yl-10-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-1-yl-9-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-2-yl-9-phenanthren-2-yl-2-phenylanthracene
SMILESc1ccc(-c2ccc3c(-c4ccc5c(ccc6ccccc65)c4)c4cc(-c5ccccc5)ccc4c(-c4ccc5ccccc5c4)c3c2)cc1.c1ccc(-c2ccc3c(-c4ccc5ccc6ccccc6c5c4)c4ccccc4c(-c4cccc5ccccc45)c3c2)cc1.c1ccc(-c2ccc3c(-c4ccc5ccccc5c4)c4ccccc4c(-c4ccc5c(ccc6ccccc65)c4)c3c2)cc1.c1ccc(-c2ccc3c(-c4cccc5ccccc45)c4ccccc4c(-c4ccc5ccc6ccccc6c5c4)c3c2)cc1
InChIInChI=1S/C50H32.3C44H28/c1-3-11-33(12-4-1)38-24-28-46-47(31-38)49(41-22-19-35-15-7-8-17-37(35)29-41)45-27-23-39(34-13-5-2-6-14-34)32-48(45)50(46)42-25-26-44-40(30-42)21-20-36-16-9-10-18-43(36)44;1-2-11-29(12-3-1)33-25-26-40-42(27-33)43(34-24-23-32-22-21-31-14-5-7-17-36(31)41(32)28-34)38-18-8-9-19-39(38)44(40)37-20-10-15-30-13-4-6-16-35(30)37;1-2-11-29(12-3-1)33-25-26-40-42(27-33)44(37-20-10-15-30-13-4-6-16-35(30)37)39-19-9-8-18-38(39)43(40)34-24-23-32-22-21-31-14-5-7-17-36(31)41(32)28-34;1-2-10-29(11-3-1)33-22-25-41-42(28-33)44(36-23-24-38-34(27-36)20-19-31-13-6-7-15-37(31)38)40-17-9-8-16-39(40)43(41)35-21-18-30-12-4-5-14-32(30)26-35/h1-32H;3*1-28H
InChIKeyVOLHNHDFHTZUEV-UHFFFAOYSA-N
XLogP51.48
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds13
Heavy Atoms182
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002302.93
LogP ≤ 551.48
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-naphthalen-2-yl-10-phenanthren-2-yl-2,6-diphenylanthracene;9-naphthalen-1-yl-10-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-1-yl-9-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-2-yl-9-phenanthren-2-yl-2-phenylanthracene with MolForge

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Related Compounds

10-naphthalen-1-yl-9-naphthalen-2-yl-2-(4-phenylphenyl)anthracene
CID 59766348
9-naphthalen-1-yl-10-naphthalen-2-yl-2,6-diphenylanthracene
CID 123330330
9,10-dinaphthalen-1-yl-2-phenylanthracene;2-naphthalen-2-yl-9,10-diphenylanthracene;10-naphthalen-1-yl-2-naphthalen-2-yl-9-phenylanthracene;9-naphthalen-1-yl-2-phenyl-10-(4-phenylphenyl)anthracene;9-naphthalen-2-yl-2-phenyl-10-(4-phenylphenyl)anthracene;2-phenyl-9,10-bis(4-phenylphenyl)anthracene
CID 161337169
9-naphthalen-1-yl-10-phenanthren-3-yl-2-phenylanthracene
CID 58194333
10-naphthalen-1-yl-9-(4-naphthalen-2-ylphenyl)-2-phenylanthracene
CID 58322799
4-(10-naphthalen-2-yl-2-phenylanthracen-9-yl)benzo[a]anthracene
CID 122368009
9,10-bis(4-phenylphenyl)-2-[10-(4-phenylphenyl)anthracen-9-yl]anthracene;10-naphthalen-1-yl-2-(4-naphthalen-1-ylphenyl)-9-phenylanthracene;10-naphthalen-2-yl-2-(4-naphthalen-1-ylphenyl)-9-phenylanthracene
CID 157246826
9-naphthalen-1-yl-10-(3-naphthalen-2-ylphenyl)anthracene;9-phenanthren-9-yl-10-(6-phenylnaphthalen-2-yl)anthracene;9-phenanthren-9-yl-10-(3-phenylphenyl)anthracene
CID 162239926
9-naphthalen-1-yl-10-(3-phenanthren-2-ylphenyl)anthracene;9-naphthalen-1-yl-10-(4-phenanthren-3-ylphenyl)anthracene;9-naphthalen-2-yl-10-(3-phenanthren-2-ylphenyl)anthracene;9-naphthalen-2-yl-10-(4-phenanthren-3-ylphenyl)anthracene;9-(3-naphthalen-1-ylphenyl)-10-(3-phenanthren-2-ylphenyl)anthracene;9-(3-naphthalen-2-ylphenyl)-10-(3-phenanthren-2-ylphenyl)anthracene;9-(4-naphthalen-1-ylphenyl)-10-(3-phenanthren-2-ylphenyl)anthracene;9-(3-phenanthren-2-ylphenyl)-10-(2-phenylphenyl)anthracene
CID 158900728
4-(9-naphthalen-2-yl-10-phenylanthracen-2-yl)benzo[a]anthracene;4-(10-naphthalen-2-yl-9-phenylanthracen-2-yl)benzo[a]anthracene;4-[9-naphthalen-1-yl-10-(3-phenylphenyl)anthracen-2-yl]benzo[a]anthracene;4-[10-naphthalen-1-yl-9-(3-phenylphenyl)anthracen-2-yl]benzo[a]anthracene
CID 162211913
9-naphthalen-2-yl-10-phenanthren-2-yl-2,6-diphenylanthracene;2-naphthalen-2-yl-9-phenanthren-2-yl-10-phenylanthracene;9-(3-naphthalen-1-ylphenyl)-10-phenanthren-2-ylanthracene;9-(3-naphthalen-2-ylphenyl)-10-phenanthren-2-ylanthracene;9-(4-naphthalen-1-ylphenyl)-10-phenanthren-2-ylanthracene;9-(4-naphthalen-2-ylphenyl)-10-phenanthren-2-ylanthracene;9-phenanthren-1-yl-10-(4-phenylnaphthalen-1-yl)anthracene;9-phenanthren-1-yl-10-(6-phenylnaphthalen-2-yl)anthracene
CID 158515822
10-naphthalen-1-yl-2-naphthalen-2-yl-9-(4-naphthalen-2-ylphenyl)anthracene
CID 58193908

Frequently Asked Questions

What is the IUPAC name of 9-naphthalen-2-yl-10-phenanthren-2-yl-2,6-diphenylanthracene;9-naphthalen-1-yl-10-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-1-yl-9-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-2-yl-9-phenanthren-2-yl-2-phenylanthracene?
The IUPAC name of 9-naphthalen-2-yl-10-phenanthren-2-yl-2,6-diphenylanthracene;9-naphthalen-1-yl-10-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-1-yl-9-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-2-yl-9-phenanthren-2-yl-2-phenylanthracene (CID 161355195) is 9-naphthalen-2-yl-10-phenanthren-2-yl-2,6-diphenylanthracene;9-naphthalen-1-yl-10-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-1-yl-9-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-2-yl-9-phenanthren-2-yl-2-phenylanthracene.
What is the SMILES notation for 9-naphthalen-2-yl-10-phenanthren-2-yl-2,6-diphenylanthracene;9-naphthalen-1-yl-10-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-1-yl-9-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-2-yl-9-phenanthren-2-yl-2-phenylanthracene?
The canonical SMILES for 9-naphthalen-2-yl-10-phenanthren-2-yl-2,6-diphenylanthracene;9-naphthalen-1-yl-10-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-1-yl-9-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-2-yl-9-phenanthren-2-yl-2-phenylanthracene is c1ccc(-c2ccc3c(-c4ccc5c(ccc6ccccc65)c4)c4cc(-c5ccccc5)ccc4c(-c4ccc5ccccc5c4)c3c2)cc1.c1ccc(-c2ccc3c(-c4ccc5ccc6ccccc6c5c4)c4ccccc4c(-c4cccc5ccccc45)c3c2)cc1.c1ccc(-c2ccc3c(-c4ccc5ccccc5c4)c4ccccc4c(-c4ccc5c(ccc6ccccc65)c4)c3c2)cc1.c1ccc(-c2ccc3c(-c4cccc5ccccc45)c4ccccc4c(-c4ccc5ccc6ccccc6c5c4)c3c2)cc1.
What is the InChIKey of 9-naphthalen-2-yl-10-phenanthren-2-yl-2,6-diphenylanthracene;9-naphthalen-1-yl-10-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-1-yl-9-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-2-yl-9-phenanthren-2-yl-2-phenylanthracene?
The InChIKey is VOLHNHDFHTZUEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H32.3C44H28/c1-3-11-33(12-4-1)38-24-28-46-47(31-38)49(41-22-19-35-15-7-8-17-37(35)29-41)45-27-23-39(34-13-5-2-6-14-34)32-48(45)50(46)42-25-26-44-40(30-42)21-20-36-16-9-10-18-43(36)44;1-2-11-29(12-3-1)33-25-26-40-42(27-33)43(34-24-23-32-22-21-31-14-5-7-17-36(31)41(32)28-34)38-18-8-9-19-39(38)44(40)37-20-10-15-30-13-4-6-16-35(30)37;1-2-11-29(12-3-1)33-25-26-40-42(27-33)44(37-20-10-15-30-13-4-6-16-35(30)37)39-19-9-8-18-38(39)43(40)34-24-23-32-22-21-31-14-5-7-17-36(31)41(32)28-34;1-2-10-29(11-3-1)33-22-25-41-42(28-33)44(36-23-24-38-34(27-36)20-19-31-13-6-7-15-37(31)38)40-17-9-8-16-39(40)43(41)35-21-18-30-12-4-5-14-32(30)26-35/h1-32H;3*1-28H.
What are the key properties of 9-naphthalen-2-yl-10-phenanthren-2-yl-2,6-diphenylanthracene;9-naphthalen-1-yl-10-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-1-yl-9-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-2-yl-9-phenanthren-2-yl-2-phenylanthracene?
9-naphthalen-2-yl-10-phenanthren-2-yl-2,6-diphenylanthracene;9-naphthalen-1-yl-10-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-1-yl-9-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-2-yl-9-phenanthren-2-yl-2-phenylanthracene has a molecular weight of 2302.93 g/mol, XLogP of 51.48, 13 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-naphthalen-2-yl-10-phenanthren-2-yl-2,6-diphenylanthracene;9-naphthalen-1-yl-10-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-1-yl-9-phenanthren-3-yl-2-phenylanthracene;10-naphthalen-2-yl-9-phenanthren-2-yl-2-phenylanthracene is sourced from PubChem (CID 161355195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).