9,10-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]anthracene;9,10-bis[4-(3,5-diphenylphenyl)phenyl]anthracene;9,10-bis(4-naphthalen-2-ylphenyl)anthracene;9,10-bis[4-(3-phenylphenyl)phenyl]anthracene;2-[4-(9,10-diphenylanthracen-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine

C261H179N3 — CID 158315885

IUPAC9,10-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]anthracene;9,10-bis[4-(3,5-diphenylphenyl)phenyl]anthracene;9,10-bis(4-naphthalen-2-ylphenyl)anthracene;9,10-bis[4-(3-phenylphenyl)phenyl]anthracene;2-[4-(9,10-diphenylanthracen-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc(-c4c5ccccc5c(-c5ccc(-c6ccc7c(c6)C(C)(C)c6ccccc6-7)cc5)c5ccccc45)cc3)cc21.c1ccc(-c2cc(-c3ccccc3)cc(-c3ccc(-c4c5ccccc5c(-c5ccc(-c6cc(-c7ccccc7)cc(-c7ccccc7)c6)cc5)c5ccccc45)cc3)c2)cc1.c1ccc(-c2cccc(-c3ccc(-c4c5ccccc5c(-c5ccc(-c6cccc(-c7ccccc7)c6)cc5)c5ccccc45)cc3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc5c(-c6ccccc6)c6ccccc6c(-c6ccccc6)c5c4)cc3)n2)cc1.c1ccc2cc(-c3ccc(-c4c5ccccc5c(-c5ccc(-c6ccc7ccccc7c6)cc5)c5ccccc45)cc3)ccc2c1
InChIInChI=1S/C62H42.C56H42.C50H34.C47H31N3.C46H30/c1-5-17-43(18-6-1)51-37-52(44-19-7-2-8-20-44)40-55(39-51)47-29-33-49(34-30-47)61-57-25-13-15-27-59(57)62(60-28-16-14-26-58(60)61)50-35-31-48(32-36-50)56-41-53(45-21-9-3-10-22-45)38-54(42-56)46-23-11-4-12-24-46;1-55(2)49-19-11-9-13-41(49)43-31-29-39(33-51(43)55)35-21-25-37(26-22-35)53-45-15-5-7-17-47(45)54(48-18-8-6-16-46(48)53)38-27-23-36(24-28-38)40-30-32-44-42-14-10-12-20-50(42)56(3,4)52(44)34-40;1-3-13-35(14-4-1)41-17-11-19-43(33-41)37-25-29-39(30-26-37)49-45-21-7-9-23-47(45)50(48-24-10-8-22-46(48)49)40-31-27-38(28-32-40)44-20-12-18-42(34-44)36-15-5-2-6-16-36;1-5-15-33(16-6-1)43-39-23-13-14-24-40(39)44(34-17-7-2-8-18-34)42-31-38(29-30-41(42)43)32-25-27-37(28-26-32)47-49-45(35-19-9-3-10-20-35)48-46(50-47)36-21-11-4-12-22-36;1-3-11-37-29-39(27-21-31(37)9-1)33-17-23-35(24-18-33)45-41-13-5-7-15-43(41)46(44-16-8-6-14-42(44)45)36-25-19-34(20-26-36)40-28-22-32-10-2-4-12-38(32)30-40/h1-42H;5-34H,1-4H3;1-34H;1-31H;1-30H
InChIKeyGOGFERDBMUQTAQ-UHFFFAOYSA-N
MW3357.32 g/mol
LogP71.75
Rot. Bonds28

About 9,10-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]anthracene;9,10-bis[4-(3,5-diphenylphenyl)phenyl]anthracene;9,10-bis(4-naphthalen-2-ylphenyl)anthracene;9,10-bis[4-(3-phenylphenyl)phenyl]anthracene;2-[4-(9,10-diphenylanthracen-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine

9,10-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]anthracene;9,10-bis[4-(3,5-diphenylphenyl)phenyl]anthracene;9,10-bis(4-naphthalen-2-ylphenyl)anthracene;9,10-bis[4-(3-phenylphenyl)phenyl]anthracene;2-[4-(9,10-diphenylanthracen-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine (PubChem CID 158315885) has the molecular formula C261H179N3 and a molecular weight of 3357.32 g/mol. Its IUPAC name is 9,10-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]anthracene;9,10-bis[4-(3,5-diphenylphenyl)phenyl]anthracene;9,10-bis(4-naphthalen-2-ylphenyl)anthracene;9,10-bis[4-(3-phenylphenyl)phenyl]anthracene;2-[4-(9,10-diphenylanthracen-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine.

Molecular Properties

Compound Name9,10-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]anthracene;9,10-bis[4-(3,5-diphenylphenyl)phenyl]anthracene;9,10-bis(4-naphthalen-2-ylphenyl)anthracene;9,10-bis[4-(3-phenylphenyl)phenyl]anthracene;2-[4-(9,10-diphenylanthracen-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine
PubChem CID158315885
Molecular FormulaC261H179N3
Molecular Weight3357.32 g/mol
Exact Mass3354.41
IUPAC Name9,10-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]anthracene;9,10-bis[4-(3,5-diphenylphenyl)phenyl]anthracene;9,10-bis(4-naphthalen-2-ylphenyl)anthracene;9,10-bis[4-(3-phenylphenyl)phenyl]anthracene;2-[4-(9,10-diphenylanthracen-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc(-c4c5ccccc5c(-c5ccc(-c6ccc7c(c6)C(C)(C)c6ccccc6-7)cc5)c5ccccc45)cc3)cc21.c1ccc(-c2cc(-c3ccccc3)cc(-c3ccc(-c4c5ccccc5c(-c5ccc(-c6cc(-c7ccccc7)cc(-c7ccccc7)c6)cc5)c5ccccc45)cc3)c2)cc1.c1ccc(-c2cccc(-c3ccc(-c4c5ccccc5c(-c5ccc(-c6cccc(-c7ccccc7)c6)cc5)c5ccccc45)cc3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc5c(-c6ccccc6)c6ccccc6c(-c6ccccc6)c5c4)cc3)n2)cc1.c1ccc2cc(-c3ccc(-c4c5ccccc5c(-c5ccc(-c6ccc7ccccc7c6)cc5)c5ccccc45)cc3)ccc2c1
InChIInChI=1S/C62H42.C56H42.C50H34.C47H31N3.C46H30/c1-5-17-43(18-6-1)51-37-52(44-19-7-2-8-20-44)40-55(39-51)47-29-33-49(34-30-47)61-57-25-13-15-27-59(57)62(60-28-16-14-26-58(60)61)50-35-31-48(32-36-50)56-41-53(45-21-9-3-10-22-45)38-54(42-56)46-23-11-4-12-24-46;1-55(2)49-19-11-9-13-41(49)43-31-29-39(33-51(43)55)35-21-25-37(26-22-35)53-45-15-5-7-17-47(45)54(48-18-8-6-16-46(48)53)38-27-23-36(24-28-38)40-30-32-44-42-14-10-12-20-50(42)56(3,4)52(44)34-40;1-3-13-35(14-4-1)41-17-11-19-43(33-41)37-25-29-39(30-26-37)49-45-21-7-9-23-47(45)50(48-24-10-8-22-46(48)49)40-31-27-38(28-32-40)44-20-12-18-42(34-44)36-15-5-2-6-16-36;1-5-15-33(16-6-1)43-39-23-13-14-24-40(39)44(34-17-7-2-8-18-34)42-31-38(29-30-41(42)43)32-25-27-37(28-26-32)47-49-45(35-19-9-3-10-20-35)48-46(50-47)36-21-11-4-12-22-36;1-3-11-37-29-39(27-21-31(37)9-1)33-17-23-35(24-18-33)45-41-13-5-7-15-43(41)46(44-16-8-6-14-42(44)45)36-25-19-34(20-26-36)40-28-22-32-10-2-4-12-38(32)30-40/h1-42H;5-34H,1-4H3;1-34H;1-31H;1-30H
InChIKeyGOGFERDBMUQTAQ-UHFFFAOYSA-N
XLogP71.75
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds28
Heavy Atoms264
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003357.32
LogP ≤ 571.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 9,10-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]anthracene;9,10-bis[4-(3,5-diphenylphenyl)phenyl]anthracene;9,10-bis(4-naphthalen-2-ylphenyl)anthracene;9,10-bis[4-(3-phenylphenyl)phenyl]anthracene;2-[4-(9,10-diphenylanthracen-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine with MolForge

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Related Compounds

10-(9,9-dimethylfluoren-2-yl)-2,9-dinaphthalen-2-ylanthracene;2,10-diphenyl-9-(4-phenylphenyl)anthracene;2,9,10-tris(9,9-dimethylfluoren-2-yl)anthracene
CID 162071769
9,10-bis(4-phenylphenyl)-2-[10-(4-phenylphenyl)anthracen-9-yl]anthracene;2-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]-9,10-bis(4-phenylphenyl)anthracene;2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-9,10-bis(4-phenylphenyl)anthracene
CID 159520005
2-(9,9-dimethylfluoren-2-yl)-9,10-bis(3-naphthalen-2-ylphenyl)anthracene
CID 143930053
10-(9,9-dimethylfluoren-2-yl)-2-naphthalen-2-yl-9-phenylanthracene
CID 58323304
9-(9,9-dimethylfluoren-2-yl)-2-naphthalen-2-yl-10-[4-(10-phenylanthracen-9-yl)phenyl]anthracene
CID 59195124
9-(9,9-dimethylfluoren-2-yl)-2-naphthalen-2-yl-10-(10-phenylanthracen-9-yl)anthracene
CID 59195394
9,10-bis(9,9-dimethylfluoren-2-yl)-2-naphthalen-2-ylanthracene;2-(9,9-dimethylfluoren-2-yl)-6,9,10-triphenylanthracene;9-(4-naphthalen-1-ylphenyl)-2,6,10-triphenylanthracene
CID 161463113
2-[4-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]phenyl]-9,10-diphenylanthracene;2-(9,9-dimethylfluoren-2-yl)-9,10-dinaphthalen-2-ylanthracene;2-(9,9-dimethylfluoren-2-yl)-9,10-diphenylanthracene;9,10-dinaphthalen-2-yl-2-(4-naphthalen-1-ylphenyl)anthracene;9,10-diphenyl-2-[10-(4-phenylphenyl)anthracen-9-yl]anthracene;2-(10-naphthalen-2-ylanthracen-9-yl)-9,10-diphenylanthracene
CID 159374462
9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-yl-2-naphthalen-2-ylanthracene;10-(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-yl-2-phenylanthracene;9-(9,9-dimethylfluoren-2-yl)-2-phenyl-10-(4-phenylphenyl)anthracene;2,9-dinaphthalen-1-yl-10-(4-phenylphenyl)anthracene;9-naphthalen-1-yl-10-naphthalen-2-yl-2-(10-phenylanthracen-9-yl)anthracene;9-naphthalen-1-yl-2-phenyl-10-(4-phenylphenyl)anthracene
CID 159934414
2-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-yl-9-naphthalen-2-ylanthracene;10-naphthalen-1-yl-2,9-dinaphthalen-2-ylanthracene;2-naphthalen-1-yl-9-phenyl-10-(4-phenylphenyl)anthracene;2-(4-naphthalen-2-ylphenyl)-9-phenyl-10-(4-phenylphenyl)anthracene
CID 160521969
2,9-bis(9,9-dimethylfluoren-2-yl)-10-naphthalen-2-ylanthracene;10-(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-yl-2-phenylanthracene;2,9-dinaphthalen-1-yl-10-(4-phenylphenyl)anthracene
CID 160579929
9,10-bis(9,9-dimethylfluoren-2-yl)-2-(10-naphthalen-2-ylanthracen-9-yl)anthracene;9,10-bis(9,9-dimethylfluoren-2-yl)-2-[10-(4-phenylphenyl)anthracen-9-yl]anthracene;2-(9,9-dimethylfluoren-2-yl)-9,10-bis(4-phenylphenyl)anthracene;2-(10-naphthalen-2-ylanthracen-9-yl)-9,10-bis(4-phenylphenyl)anthracene;2-phenanthren-9-yl-9,10-bis(4-phenylphenyl)anthracene
CID 157129330

Frequently Asked Questions

What is the IUPAC name of 9,10-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]anthracene;9,10-bis[4-(3,5-diphenylphenyl)phenyl]anthracene;9,10-bis(4-naphthalen-2-ylphenyl)anthracene;9,10-bis[4-(3-phenylphenyl)phenyl]anthracene;2-[4-(9,10-diphenylanthracen-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine?
The IUPAC name of 9,10-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]anthracene;9,10-bis[4-(3,5-diphenylphenyl)phenyl]anthracene;9,10-bis(4-naphthalen-2-ylphenyl)anthracene;9,10-bis[4-(3-phenylphenyl)phenyl]anthracene;2-[4-(9,10-diphenylanthracen-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine (CID 158315885) is 9,10-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]anthracene;9,10-bis[4-(3,5-diphenylphenyl)phenyl]anthracene;9,10-bis(4-naphthalen-2-ylphenyl)anthracene;9,10-bis[4-(3-phenylphenyl)phenyl]anthracene;2-[4-(9,10-diphenylanthracen-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine.
What is the SMILES notation for 9,10-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]anthracene;9,10-bis[4-(3,5-diphenylphenyl)phenyl]anthracene;9,10-bis(4-naphthalen-2-ylphenyl)anthracene;9,10-bis[4-(3-phenylphenyl)phenyl]anthracene;2-[4-(9,10-diphenylanthracen-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine?
The canonical SMILES for 9,10-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]anthracene;9,10-bis[4-(3,5-diphenylphenyl)phenyl]anthracene;9,10-bis(4-naphthalen-2-ylphenyl)anthracene;9,10-bis[4-(3-phenylphenyl)phenyl]anthracene;2-[4-(9,10-diphenylanthracen-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine is CC1(C)c2ccccc2-c2ccc(-c3ccc(-c4c5ccccc5c(-c5ccc(-c6ccc7c(c6)C(C)(C)c6ccccc6-7)cc5)c5ccccc45)cc3)cc21.c1ccc(-c2cc(-c3ccccc3)cc(-c3ccc(-c4c5ccccc5c(-c5ccc(-c6cc(-c7ccccc7)cc(-c7ccccc7)c6)cc5)c5ccccc45)cc3)c2)cc1.c1ccc(-c2cccc(-c3ccc(-c4c5ccccc5c(-c5ccc(-c6cccc(-c7ccccc7)c6)cc5)c5ccccc45)cc3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc5c(-c6ccccc6)c6ccccc6c(-c6ccccc6)c5c4)cc3)n2)cc1.c1ccc2cc(-c3ccc(-c4c5ccccc5c(-c5ccc(-c6ccc7ccccc7c6)cc5)c5ccccc45)cc3)ccc2c1.
What is the InChIKey of 9,10-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]anthracene;9,10-bis[4-(3,5-diphenylphenyl)phenyl]anthracene;9,10-bis(4-naphthalen-2-ylphenyl)anthracene;9,10-bis[4-(3-phenylphenyl)phenyl]anthracene;2-[4-(9,10-diphenylanthracen-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine?
The InChIKey is GOGFERDBMUQTAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H42.C56H42.C50H34.C47H31N3.C46H30/c1-5-17-43(18-6-1)51-37-52(44-19-7-2-8-20-44)40-55(39-51)47-29-33-49(34-30-47)61-57-25-13-15-27-59(57)62(60-28-16-14-26-58(60)61)50-35-31-48(32-36-50)56-41-53(45-21-9-3-10-22-45)38-54(42-56)46-23-11-4-12-24-46;1-55(2)49-19-11-9-13-41(49)43-31-29-39(33-51(43)55)35-21-25-37(26-22-35)53-45-15-5-7-17-47(45)54(48-18-8-6-16-46(48)53)38-27-23-36(24-28-38)40-30-32-44-42-14-10-12-20-50(42)56(3,4)52(44)34-40;1-3-13-35(14-4-1)41-17-11-19-43(33-41)37-25-29-39(30-26-37)49-45-21-7-9-23-47(45)50(48-24-10-8-22-46(48)49)40-31-27-38(28-32-40)44-20-12-18-42(34-44)36-15-5-2-6-16-36;1-5-15-33(16-6-1)43-39-23-13-14-24-40(39)44(34-17-7-2-8-18-34)42-31-38(29-30-41(42)43)32-25-27-37(28-26-32)47-49-45(35-19-9-3-10-20-35)48-46(50-47)36-21-11-4-12-22-36;1-3-11-37-29-39(27-21-31(37)9-1)33-17-23-35(24-18-33)45-41-13-5-7-15-43(41)46(44-16-8-6-14-42(44)45)36-25-19-34(20-26-36)40-28-22-32-10-2-4-12-38(32)30-40/h1-42H;5-34H,1-4H3;1-34H;1-31H;1-30H.
What are the key properties of 9,10-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]anthracene;9,10-bis[4-(3,5-diphenylphenyl)phenyl]anthracene;9,10-bis(4-naphthalen-2-ylphenyl)anthracene;9,10-bis[4-(3-phenylphenyl)phenyl]anthracene;2-[4-(9,10-diphenylanthracen-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine?
9,10-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]anthracene;9,10-bis[4-(3,5-diphenylphenyl)phenyl]anthracene;9,10-bis(4-naphthalen-2-ylphenyl)anthracene;9,10-bis[4-(3-phenylphenyl)phenyl]anthracene;2-[4-(9,10-diphenylanthracen-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine has a molecular weight of 3357.32 g/mol, XLogP of 71.75, 28 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9,10-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]anthracene;9,10-bis[4-(3,5-diphenylphenyl)phenyl]anthracene;9,10-bis(4-naphthalen-2-ylphenyl)anthracene;9,10-bis[4-(3-phenylphenyl)phenyl]anthracene;2-[4-(9,10-diphenylanthracen-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine is sourced from PubChem (CID 158315885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).