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

C199H132 — CID 159520005

IUPAC9,10-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
SMILESCC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc5c(-c6ccc(-c7ccccc7)cc6)c6ccccc6c(-c6ccc(-c7ccccc7)cc6)c5c4)c4ccccc34)cc21.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc(-c5ccccc5)cc4)c4cc(-c5ccc(-c6c7ccccc7c(-c7ccc8ccccc8c7)c7ccccc67)cc5)ccc34)cc2)cc1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc5c(-c6ccc(-c7ccccc7)cc6)c6ccccc6c(-c6ccc(-c7ccccc7)cc6)c5c4)c4ccccc34)cc2)cc1
InChIInChI=1S/C68H44.C67H46.C64H42/c1-3-15-45(16-4-1)48-27-34-52(35-28-48)66-57-21-9-12-24-60(57)67(53-36-29-49(30-37-53)46-17-5-2-6-18-46)64-44-55(41-42-63(64)66)50-31-38-51(39-32-50)65-58-22-10-13-25-61(58)68(62-26-14-11-23-59(62)65)56-40-33-47-19-7-8-20-54(47)43-56;1-67(2)61-28-16-15-21-51(61)52-39-37-50(42-62(52)67)66-57-26-13-11-24-55(57)65(56-25-12-14-27-58(56)66)49-38-40-59-60(41-49)64(48-35-31-46(32-36-48)44-19-7-4-8-20-44)54-23-10-9-22-53(54)63(59)47-33-29-45(30-34-47)43-17-5-3-6-18-43;1-4-16-43(17-5-1)46-28-34-49(35-29-46)61-54-23-11-14-26-57(54)64(58-27-15-12-24-55(58)61)52-40-41-59-60(42-52)63(51-38-32-48(33-39-51)45-20-8-3-9-21-45)56-25-13-10-22-53(56)62(59)50-36-30-47(31-37-50)44-18-6-2-7-19-44/h1-44H;3-42H,1-2H3;1-42H
InChIKeyMBROATDSUNYMKA-UHFFFAOYSA-N
MW2523.24 g/mol
LogP55.70
Rot. Bonds20

About 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

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 (PubChem CID 159520005) has the molecular formula C199H132 and a molecular weight of 2523.24 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name9,10-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
PubChem CID159520005
Molecular FormulaC199H132
Molecular Weight2523.24 g/mol
Exact Mass2521.03
IUPAC Name9,10-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
SMILESCC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc5c(-c6ccc(-c7ccccc7)cc6)c6ccccc6c(-c6ccc(-c7ccccc7)cc6)c5c4)c4ccccc34)cc21.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc(-c5ccccc5)cc4)c4cc(-c5ccc(-c6c7ccccc7c(-c7ccc8ccccc8c7)c7ccccc67)cc5)ccc34)cc2)cc1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc5c(-c6ccc(-c7ccccc7)cc6)c6ccccc6c(-c6ccc(-c7ccccc7)cc6)c5c4)c4ccccc34)cc2)cc1
InChIInChI=1S/C68H44.C67H46.C64H42/c1-3-15-45(16-4-1)48-27-34-52(35-28-48)66-57-21-9-12-24-60(57)67(53-36-29-49(30-37-53)46-17-5-2-6-18-46)64-44-55(41-42-63(64)66)50-31-38-51(39-32-50)65-58-22-10-13-25-61(58)68(62-26-14-11-23-59(62)65)56-40-33-47-19-7-8-20-54(47)43-56;1-67(2)61-28-16-15-21-51(61)52-39-37-50(42-62(52)67)66-57-26-13-11-24-55(57)65(56-25-12-14-27-58(56)66)49-38-40-59-60(41-49)64(48-35-31-46(32-36-48)44-19-7-4-8-20-44)54-23-10-9-22-53(54)63(59)47-33-29-45(30-34-47)43-17-5-3-6-18-43;1-4-16-43(17-5-1)46-28-34-49(35-29-46)61-54-23-11-14-26-57(54)64(58-27-15-12-24-55(58)61)52-40-41-59-60(42-52)63(51-38-32-48(33-39-51)45-20-8-3-9-21-45)56-25-13-10-22-53(56)62(59)50-36-30-47(31-37-50)44-18-6-2-7-19-44/h1-44H;3-42H,1-2H3;1-42H
InChIKeyMBROATDSUNYMKA-UHFFFAOYSA-N
XLogP55.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds20
Heavy Atoms199
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002523.24
LogP ≤ 555.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 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 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
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
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
9,10-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
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
2-(9,9-dimethylfluoren-2-yl)-9,10-bis(3-naphthalen-2-ylphenyl)anthracene
CID 143930053
9-(9,9-dimethylfluoren-2-yl)-2-naphthalen-2-yl-10-(4-phenylnaphthalen-1-yl)anthracene
CID 59195223
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-(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
8-(9,9-dimethylfluoren-2-yl)-13-(9,9-dimethylfluoren-3-yl)-5-naphthalen-2-yl-6,11-diphenylbenzo[a]tetracene
CID 123220371

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc5c(-c6ccc(-c7ccccc7)cc6)c6ccccc6c(-c6ccc(-c7ccccc7)cc6)c5c4)c4ccccc34)cc21.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc(-c5ccccc5)cc4)c4cc(-c5ccc(-c6c7ccccc7c(-c7ccc8ccccc8c7)c7ccccc67)cc5)ccc34)cc2)cc1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc5c(-c6ccc(-c7ccccc7)cc6)c6ccccc6c(-c6ccc(-c7ccccc7)cc6)c5c4)c4ccccc34)cc2)cc1.
What is the InChIKey of 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?
The InChIKey is MBROATDSUNYMKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H44.C67H46.C64H42/c1-3-15-45(16-4-1)48-27-34-52(35-28-48)66-57-21-9-12-24-60(57)67(53-36-29-49(30-37-53)46-17-5-2-6-18-46)64-44-55(41-42-63(64)66)50-31-38-51(39-32-50)65-58-22-10-13-25-61(58)68(62-26-14-11-23-59(62)65)56-40-33-47-19-7-8-20-54(47)43-56;1-67(2)61-28-16-15-21-51(61)52-39-37-50(42-62(52)67)66-57-26-13-11-24-55(57)65(56-25-12-14-27-58(56)66)49-38-40-59-60(41-49)64(48-35-31-46(32-36-48)44-19-7-4-8-20-44)54-23-10-9-22-53(54)63(59)47-33-29-45(30-34-47)43-17-5-3-6-18-43;1-4-16-43(17-5-1)46-28-34-49(35-29-46)61-54-23-11-14-26-57(54)64(58-27-15-12-24-55(58)61)52-40-41-59-60(42-52)63(51-38-32-48(33-39-51)45-20-8-3-9-21-45)56-25-13-10-22-53(56)62(59)50-36-30-47(31-37-50)44-18-6-2-7-19-44/h1-44H;3-42H,1-2H3;1-42H.
What are the key properties of 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?
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 has a molecular weight of 2523.24 g/mol, XLogP of 55.70, 20 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 159520005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).