9,10-bis(2-naphthalen-1-ylphenyl)anthracene;9,10-bis(2-naphthalen-2-ylphenyl)anthracene

C92H60 — CID 160569963

IUPAC9,10-bis(2-naphthalen-1-ylphenyl)anthracene;9,10-bis(2-naphthalen-2-ylphenyl)anthracene
SMILESc1ccc(-c2c3ccccc3c(-c3ccccc3-c3ccc4ccccc4c3)c3ccccc23)c(-c2ccc3ccccc3c2)c1.c1ccc(-c2c3ccccc3c(-c3ccccc3-c3cccc4ccccc34)c3ccccc23)c(-c2cccc3ccccc23)c1
InChIInChI=1S/2C46H30/c1-3-19-33-31(15-1)17-13-29-35(33)37-21-5-7-23-39(37)45-41-25-9-11-27-43(41)46(44-28-12-10-26-42(44)45)40-24-8-6-22-38(40)36-30-14-18-32-16-2-4-20-34(32)36;1-3-15-33-29-35(27-25-31(33)13-1)37-17-5-7-19-39(37)45-41-21-9-11-23-43(41)46(44-24-12-10-22-42(44)45)40-20-8-6-18-38(40)36-28-26-32-14-2-4-16-34(32)30-36/h2*1-30H
InChIKeyRAKMWPTUXBMXHT-UHFFFAOYSA-N
MW1165.49 g/mol
LogP25.93
Rot. Bonds8

About 9,10-bis(2-naphthalen-1-ylphenyl)anthracene;9,10-bis(2-naphthalen-2-ylphenyl)anthracene

9,10-bis(2-naphthalen-1-ylphenyl)anthracene;9,10-bis(2-naphthalen-2-ylphenyl)anthracene (PubChem CID 160569963) has the molecular formula C92H60 and a molecular weight of 1165.49 g/mol. Its IUPAC name is 9,10-bis(2-naphthalen-1-ylphenyl)anthracene;9,10-bis(2-naphthalen-2-ylphenyl)anthracene.

Molecular Properties

Compound Name9,10-bis(2-naphthalen-1-ylphenyl)anthracene;9,10-bis(2-naphthalen-2-ylphenyl)anthracene
PubChem CID160569963
Molecular FormulaC92H60
Molecular Weight1165.49 g/mol
Exact Mass1164.47
IUPAC Name9,10-bis(2-naphthalen-1-ylphenyl)anthracene;9,10-bis(2-naphthalen-2-ylphenyl)anthracene
SMILESc1ccc(-c2c3ccccc3c(-c3ccccc3-c3ccc4ccccc4c3)c3ccccc23)c(-c2ccc3ccccc3c2)c1.c1ccc(-c2c3ccccc3c(-c3ccccc3-c3cccc4ccccc34)c3ccccc23)c(-c2cccc3ccccc23)c1
InChIInChI=1S/2C46H30/c1-3-19-33-31(15-1)17-13-29-35(33)37-21-5-7-23-39(37)45-41-25-9-11-27-43(41)46(44-28-12-10-26-42(44)45)40-24-8-6-22-38(40)36-30-14-18-32-16-2-4-20-34(32)36;1-3-15-33-29-35(27-25-31(33)13-1)37-17-5-7-19-39(37)45-41-21-9-11-23-43(41)46(44-24-12-10-22-42(44)45)40-20-8-6-18-38(40)36-28-26-32-14-2-4-16-34(32)30-36/h2*1-30H
InChIKeyRAKMWPTUXBMXHT-UHFFFAOYSA-N
XLogP25.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms92
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001165.49
LogP ≤ 525.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

10-naphthalen-1-yl-2-(2-naphthalen-1-ylphenyl)-9-(2-naphthalen-2-ylphenyl)anthracene
CID 58322843
9-naphthalen-1-yl-2-naphthalen-2-yl-10-(2-naphthalen-2-ylphenyl)anthracene
CID 58323226
2,9-dinaphthalen-2-yl-10-(2-naphthalen-1-ylphenyl)anthracene
CID 58322851
9-(2-naphthalen-1-ylphenyl)-10-phenylanthracene;9-(2-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(3-naphthalen-1-ylphenyl)-10-phenylanthracene;9-(3-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(4-naphthalen-1-ylphenyl)-10-phenylanthracene;9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene
CID 165020657
9-(2-naphthalen-2-ylphenyl)-10-(3-naphthalen-2-ylphenyl)anthracene
CID 144568902
bis(9-(2-naphthalen-1-ylphenyl)-10-(4-phenylphenyl)anthracene);9-(3-naphthalen-1-ylphenyl)-10-(4-phenylphenyl)anthracene;9-(3-naphthalen-2-ylphenyl)-10-(4-phenylphenyl)anthracene;9-(4-naphthalen-1-ylphenyl)-10-(4-phenylphenyl)anthracene;9-(4-naphthalen-2-ylphenyl)-10-(4-phenylphenyl)anthracene
CID 165092129
2-naphthalen-1-yl-9,10-bis(2-naphthalen-1-ylphenyl)anthracene
CID 172698241
9-(2-naphthalen-1-ylphenyl)-10-phenylanthracene;9-(2-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(3-naphthalen-1-ylphenyl)-10-phenylanthracene;9-(3-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(4-naphthalen-1-ylphenyl)-10-phenylanthracene;9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(4-phenanthren-1-ylphenyl)-10-phenylanthracene;9-phenyl-10-(2-phenylphenyl)anthracene;9-phenyl-10-(3-phenylphenyl)anthracene;9-phenyl-10-(4-phenylphenyl)anthracene
CID 165066854
9,10-bis(2-naphthalen-1-ylphenyl)anthracene
CID 22138017
10-naphthalen-1-yl-2-naphthalen-2-yl-9-(2-phenylphenyl)anthracene
CID 58323519
ethane;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene
CID 91401240
9-naphthalen-1-yl-10-[6-(6-naphthalen-1-ylnaphthalen-2-yl)naphthalen-2-yl]anthracene
CID 123515173

Frequently Asked Questions

What is the IUPAC name of 9,10-bis(2-naphthalen-1-ylphenyl)anthracene;9,10-bis(2-naphthalen-2-ylphenyl)anthracene?
The IUPAC name of 9,10-bis(2-naphthalen-1-ylphenyl)anthracene;9,10-bis(2-naphthalen-2-ylphenyl)anthracene (CID 160569963) is 9,10-bis(2-naphthalen-1-ylphenyl)anthracene;9,10-bis(2-naphthalen-2-ylphenyl)anthracene.
What is the SMILES notation for 9,10-bis(2-naphthalen-1-ylphenyl)anthracene;9,10-bis(2-naphthalen-2-ylphenyl)anthracene?
The canonical SMILES for 9,10-bis(2-naphthalen-1-ylphenyl)anthracene;9,10-bis(2-naphthalen-2-ylphenyl)anthracene is c1ccc(-c2c3ccccc3c(-c3ccccc3-c3ccc4ccccc4c3)c3ccccc23)c(-c2ccc3ccccc3c2)c1.c1ccc(-c2c3ccccc3c(-c3ccccc3-c3cccc4ccccc34)c3ccccc23)c(-c2cccc3ccccc23)c1.
What is the InChIKey of 9,10-bis(2-naphthalen-1-ylphenyl)anthracene;9,10-bis(2-naphthalen-2-ylphenyl)anthracene?
The InChIKey is RAKMWPTUXBMXHT-UHFFFAOYSA-N. The full InChI is InChI=1S/2C46H30/c1-3-19-33-31(15-1)17-13-29-35(33)37-21-5-7-23-39(37)45-41-25-9-11-27-43(41)46(44-28-12-10-26-42(44)45)40-24-8-6-22-38(40)36-30-14-18-32-16-2-4-20-34(32)36;1-3-15-33-29-35(27-25-31(33)13-1)37-17-5-7-19-39(37)45-41-21-9-11-23-43(41)46(44-24-12-10-22-42(44)45)40-20-8-6-18-38(40)36-28-26-32-14-2-4-16-34(32)30-36/h2*1-30H.
What are the key properties of 9,10-bis(2-naphthalen-1-ylphenyl)anthracene;9,10-bis(2-naphthalen-2-ylphenyl)anthracene?
9,10-bis(2-naphthalen-1-ylphenyl)anthracene;9,10-bis(2-naphthalen-2-ylphenyl)anthracene has a molecular weight of 1165.49 g/mol, XLogP of 25.93, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,10-bis(2-naphthalen-1-ylphenyl)anthracene;9,10-bis(2-naphthalen-2-ylphenyl)anthracene is sourced from PubChem (CID 160569963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).