9-(2,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,5-diphenylphenyl)-10-naphthalen-2-ylanthracene

C126H84 — CID 159937267

IUPAC9-(2,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,5-diphenylphenyl)-10-naphthalen-2-ylanthracene
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4ccccc34)c2)cc1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4ccccc34)c(-c3ccccc3)c2)cc1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4ccccc34)cc2-c2ccccc2)cc1
InChIInChI=1S/3C42H28/c1-3-14-30(15-4-1)35-26-25-34(28-40(35)31-16-5-2-6-17-31)42-38-21-11-9-19-36(38)41(37-20-10-12-22-39(37)42)33-24-23-29-13-7-8-18-32(29)27-33;1-3-13-29(14-4-1)33-25-26-39(40(28-33)31-16-5-2-6-17-31)42-37-21-11-9-19-35(37)41(36-20-10-12-22-38(36)42)34-24-23-30-15-7-8-18-32(30)27-34;1-3-13-29(14-4-1)34-26-35(30-15-5-2-6-16-30)28-36(27-34)42-39-21-11-9-19-37(39)41(38-20-10-12-22-40(38)42)33-24-23-31-17-7-8-18-32(31)25-33/h3*1-28H
InChIKeyOAKJIHSJJXVYNH-UHFFFAOYSA-N
MW1598.06 g/mol
LogP35.44
Rot. Bonds12

About 9-(2,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,5-diphenylphenyl)-10-naphthalen-2-ylanthracene

9-(2,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,5-diphenylphenyl)-10-naphthalen-2-ylanthracene (PubChem CID 159937267) has the molecular formula C126H84 and a molecular weight of 1598.06 g/mol. Its IUPAC name is 9-(2,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,5-diphenylphenyl)-10-naphthalen-2-ylanthracene.

Molecular Properties

Compound Name9-(2,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,5-diphenylphenyl)-10-naphthalen-2-ylanthracene
PubChem CID159937267
Molecular FormulaC126H84
Molecular Weight1598.06 g/mol
Exact Mass1596.66
IUPAC Name9-(2,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,5-diphenylphenyl)-10-naphthalen-2-ylanthracene
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4ccccc34)c2)cc1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4ccccc34)c(-c3ccccc3)c2)cc1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4ccccc34)cc2-c2ccccc2)cc1
InChIInChI=1S/3C42H28/c1-3-14-30(15-4-1)35-26-25-34(28-40(35)31-16-5-2-6-17-31)42-38-21-11-9-19-36(38)41(37-20-10-12-22-39(37)42)33-24-23-29-13-7-8-18-32(29)27-33;1-3-13-29(14-4-1)33-25-26-39(40(28-33)31-16-5-2-6-17-31)42-37-21-11-9-19-35(37)41(36-20-10-12-22-38(36)42)34-24-23-30-15-7-8-18-32(30)27-34;1-3-13-29(14-4-1)34-26-35(30-15-5-2-6-16-30)28-36(27-34)42-39-21-11-9-19-37(39)41(38-20-10-12-22-40(38)42)33-24-23-31-17-7-8-18-32(31)25-33/h3*1-28H
InChIKeyOAKJIHSJJXVYNH-UHFFFAOYSA-N
XLogP35.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms126
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001598.06
LogP ≤ 535.44
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

9-(3,4-diphenylphenyl)-10-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]anthracene;9-(3,5-diphenylphenyl)-10-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]anthracene;methane;9-(4-naphthalen-2-ylphenyl)-10-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]anthracene;9-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]-10-[10-(4-phenylphenyl)anthracen-9-yl]anthracene;9-(6-phenylnaphthalen-2-yl)-10-[10-(2-phenylphenyl)anthracen-9-yl]anthracene;9-(6-phenylnaphthalen-2-yl)-10-[10-(3-phenylphenyl)anthracen-9-yl]anthracene;9-(6-phenylnaphthalen-2-yl)-10-[10-(4-phenylphenyl)anthracen-9-yl]anthracene;9-(6-phenylnaphthalen-2-yl)-10-[10-[2-(4-phenylphenyl)phenyl]anthracen-9-yl]anthracene
CID 158189877
9-(5-naphthalen-2-yl-2-phenylphenyl)-10-(4-phenylphenyl)anthracene
CID 176775937
9-(3,5-diphenylphenyl)-2-methyl-10-naphthalen-2-ylanthracene;9-(3,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;2-methyl-10-naphthalen-2-yl-9-(2-phenylphenyl)anthracene;2-methyl-10-naphthalen-2-yl-9-(4-phenylphenyl)anthracene;9-naphthalen-2-yl-10-(4-naphthalen-2-ylphenyl)anthracene
CID 161230883
9-[3,4-bis(2-phenylphenyl)phenyl]-10-naphthalen-2-ylanthracene;9-[3,4-bis(3-phenylphenyl)phenyl]-10-naphthalen-2-ylanthracene;9-naphthalen-2-yl-10-[4-(2-phenylphenyl)-3-(3-phenylphenyl)phenyl]anthracene
CID 157150348
9-naphthalen-2-yl-10-[10-(2-phenylphenyl)anthracen-9-yl]anthracene;9-naphthalen-2-yl-10-[10-(3-phenylphenyl)anthracen-9-yl]anthracene;9-naphthalen-2-yl-10-[10-(4-phenylphenyl)anthracen-9-yl]anthracene;9-phenyl-10-[4-(10-phenylanthracen-9-yl)phenyl]anthracene
CID 159178358
9-naphthalen-2-yl-10-(10-phenylanthracen-9-yl)anthracene;9-naphthalen-2-yl-10-[10-(2-phenylphenyl)anthracen-9-yl]anthracene;9-naphthalen-2-yl-10-[10-(3-phenylphenyl)anthracen-9-yl]anthracene;9-naphthalen-2-yl-10-[10-(4-phenylphenyl)anthracen-9-yl]anthracene
CID 161288409
5,12-bis(4-phenylphenyl)tetracene;5-(2,4-diphenylphenyl)-12-(3,4-diphenylphenyl)tetracene
CID 162258725
9-[2-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]-10-phenylanthracene
CID 123816482
9,10-bis(4-naphthalen-1-ylphenyl)anthracene;9-(3,4-diphenylphenyl)-10-(4-phenylnaphthalen-1-yl)anthracene;9-(3,5-diphenylphenyl)-10-(4-phenylnaphthalen-1-yl)anthracene;9-(4-naphthalen-1-ylnaphthalen-1-yl)-10-(6-phenylnaphthalen-2-yl)anthracene;9-(3-phenylnaphthalen-1-yl)-10-(6-phenylnaphthalen-2-yl)anthracene;9-(4-phenylnaphthalen-1-yl)-10-(2-phenylphenyl)anthracene;9-(4-phenylnaphthalen-1-yl)-10-(3-phenylphenyl)anthracene;9-(4-phenylnaphthalen-1-yl)-10-[2-(4-phenylphenyl)phenyl]anthracene;9-(4-phenylnaphthalen-1-yl)-10-[4-(4-phenylphenyl)phenyl]anthracene
CID 158384641
9-(3,5-dinaphthalen-2-ylphenyl)-10-naphthalen-2-ylanthracene;9-naphthalen-1-yl-10-(4-naphthalen-1-ylphenyl)anthracene;9-naphthalen-1-yl-10-(2-phenylphenyl)anthracene;9-naphthalen-1-yl-10-(3-phenylphenyl)anthracene;9-naphthalen-1-yl-10-[2-(4-phenylphenyl)phenyl]anthracene
CID 158532472
9-[3,5-bis[4-(3-phenylphenyl)phenyl]phenyl]-10-naphthalen-2-ylanthracene
CID 58965758
9-[6-(3-naphthalen-2-yl-5-phenylphenyl)naphthalen-2-yl]-10-phenylanthracene
CID 58590127

Frequently Asked Questions

What is the IUPAC name of 9-(2,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,5-diphenylphenyl)-10-naphthalen-2-ylanthracene?
The IUPAC name of 9-(2,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,5-diphenylphenyl)-10-naphthalen-2-ylanthracene (CID 159937267) is 9-(2,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,5-diphenylphenyl)-10-naphthalen-2-ylanthracene.
What is the SMILES notation for 9-(2,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,5-diphenylphenyl)-10-naphthalen-2-ylanthracene?
The canonical SMILES for 9-(2,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,5-diphenylphenyl)-10-naphthalen-2-ylanthracene is c1ccc(-c2cc(-c3ccccc3)cc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4ccccc34)c2)cc1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4ccccc34)c(-c3ccccc3)c2)cc1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4ccccc34)cc2-c2ccccc2)cc1.
What is the InChIKey of 9-(2,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,5-diphenylphenyl)-10-naphthalen-2-ylanthracene?
The InChIKey is OAKJIHSJJXVYNH-UHFFFAOYSA-N. The full InChI is InChI=1S/3C42H28/c1-3-14-30(15-4-1)35-26-25-34(28-40(35)31-16-5-2-6-17-31)42-38-21-11-9-19-36(38)41(37-20-10-12-22-39(37)42)33-24-23-29-13-7-8-18-32(29)27-33;1-3-13-29(14-4-1)33-25-26-39(40(28-33)31-16-5-2-6-17-31)42-37-21-11-9-19-35(37)41(36-20-10-12-22-38(36)42)34-24-23-30-15-7-8-18-32(30)27-34;1-3-13-29(14-4-1)34-26-35(30-15-5-2-6-16-30)28-36(27-34)42-39-21-11-9-19-37(39)41(38-20-10-12-22-40(38)42)33-24-23-31-17-7-8-18-32(31)25-33/h3*1-28H.
What are the key properties of 9-(2,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,5-diphenylphenyl)-10-naphthalen-2-ylanthracene?
9-(2,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,5-diphenylphenyl)-10-naphthalen-2-ylanthracene has a molecular weight of 1598.06 g/mol, XLogP of 35.44, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,4-diphenylphenyl)-10-naphthalen-2-ylanthracene;9-(3,5-diphenylphenyl)-10-naphthalen-2-ylanthracene is sourced from PubChem (CID 159937267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).