9-[4-[4-[9-[4-(4-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene;9-[9,9-bis(4-anthracen-9-ylphenyl)-7-(10-phenylanthracen-9-yl)fluoren-2-yl]-10-phenylanthracene;methane

C159H104 — CID 159419556

IUPAC9-[4-[4-[9-[4-(4-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene;9-[9,9-bis(4-anthracen-9-ylphenyl)-7-(10-phenylanthracen-9-yl)fluoren-2-yl]-10-phenylanthracene;methane
SMILESC.c1ccc(-c2c3ccccc3c(-c3ccc4c(c3)C(c3ccc(-c5c6ccccc6cc6ccccc56)cc3)(c3ccc(-c5c6ccccc6cc6ccccc56)cc3)c3cc(-c5c6ccccc6c(-c6ccccc6)c6ccccc56)ccc3-4)c3ccccc23)cc1.c1ccc2c(c1)-c1ccccc1C2(c1ccc(-c2ccc(-c3c4ccccc4cc4ccccc34)cc2)cc1)c1ccc(-c2ccc(-c3c4ccccc4cc4ccccc34)cc2)cc1
InChIInChI=1S/C93H58.C65H42.CH4/c1-3-23-59(24-4-1)89-77-35-15-19-39-81(77)91(82-40-20-16-36-78(82)89)67-47-53-75-76-54-48-68(92-83-41-21-17-37-79(83)90(60-25-5-2-6-26-60)80-38-18-22-42-84(80)92)58-86(76)93(85(75)57-67,69-49-43-61(44-50-69)87-71-31-11-7-27-63(71)55-64-28-8-12-32-72(64)87)70-51-45-62(46-52-70)88-73-33-13-9-29-65(73)56-66-30-10-14-34-74(66)88;1-5-17-55-49(13-1)41-50-14-2-6-18-56(50)63(55)47-29-25-43(26-30-47)45-33-37-53(38-34-45)65(61-23-11-9-21-59(61)60-22-10-12-24-62(60)65)54-39-35-46(36-40-54)44-27-31-48(32-28-44)64-57-19-7-3-15-51(57)42-52-16-4-8-20-58(52)64;/h1-58H;1-42H;1H4
InChIKeyLPOZCPADXIYXII-UHFFFAOYSA-N
MW2014.58 g/mol
LogP43.24
Rot. Bonds14

About 9-[4-[4-[9-[4-(4-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene;9-[9,9-bis(4-anthracen-9-ylphenyl)-7-(10-phenylanthracen-9-yl)fluoren-2-yl]-10-phenylanthracene;methane

9-[4-[4-[9-[4-(4-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene;9-[9,9-bis(4-anthracen-9-ylphenyl)-7-(10-phenylanthracen-9-yl)fluoren-2-yl]-10-phenylanthracene;methane (PubChem CID 159419556) has the molecular formula C159H104 and a molecular weight of 2014.58 g/mol. Its IUPAC name is 9-[4-[4-[9-[4-(4-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene;9-[9,9-bis(4-anthracen-9-ylphenyl)-7-(10-phenylanthracen-9-yl)fluoren-2-yl]-10-phenylanthracene;methane.

Molecular Properties

Compound Name9-[4-[4-[9-[4-(4-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene;9-[9,9-bis(4-anthracen-9-ylphenyl)-7-(10-phenylanthracen-9-yl)fluoren-2-yl]-10-phenylanthracene;methane
PubChem CID159419556
Molecular FormulaC159H104
Molecular Weight2014.58 g/mol
Exact Mass2012.81
IUPAC Name9-[4-[4-[9-[4-(4-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene;9-[9,9-bis(4-anthracen-9-ylphenyl)-7-(10-phenylanthracen-9-yl)fluoren-2-yl]-10-phenylanthracene;methane
SMILESC.c1ccc(-c2c3ccccc3c(-c3ccc4c(c3)C(c3ccc(-c5c6ccccc6cc6ccccc56)cc3)(c3ccc(-c5c6ccccc6cc6ccccc56)cc3)c3cc(-c5c6ccccc6c(-c6ccccc6)c6ccccc56)ccc3-4)c3ccccc23)cc1.c1ccc2c(c1)-c1ccccc1C2(c1ccc(-c2ccc(-c3c4ccccc4cc4ccccc34)cc2)cc1)c1ccc(-c2ccc(-c3c4ccccc4cc4ccccc34)cc2)cc1
InChIInChI=1S/C93H58.C65H42.CH4/c1-3-23-59(24-4-1)89-77-35-15-19-39-81(77)91(82-40-20-16-36-78(82)89)67-47-53-75-76-54-48-68(92-83-41-21-17-37-79(83)90(60-25-5-2-6-26-60)80-38-18-22-42-84(80)92)58-86(76)93(85(75)57-67,69-49-43-61(44-50-69)87-71-31-11-7-27-63(71)55-64-28-8-12-32-72(64)87)70-51-45-62(46-52-70)88-73-33-13-9-29-65(73)56-66-30-10-14-34-74(66)88;1-5-17-55-49(13-1)41-50-14-2-6-18-56(50)63(55)47-29-25-43(26-30-47)45-33-37-53(38-34-45)65(61-23-11-9-21-59(61)60-22-10-12-24-62(60)65)54-39-35-46(36-40-54)44-27-31-48(32-28-44)64-57-19-7-3-15-51(57)42-52-16-4-8-20-58(52)64;/h1-58H;1-42H;1H4
InChIKeyLPOZCPADXIYXII-UHFFFAOYSA-N
XLogP43.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds14
Heavy Atoms159
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002014.58
LogP ≤ 543.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 9-[4-[4-[9-[4-(4-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene;9-[9,9-bis(4-anthracen-9-ylphenyl)-7-(10-phenylanthracen-9-yl)fluoren-2-yl]-10-phenylanthracene;methane with MolForge

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Related Compounds

9-(9,9-diphenylfluoren-2-yl)-10-(4-phenylphenyl)anthracene
CID 140792270
9-[4-[9-(4-anthracen-9-ylphenyl)fluoren-9-yl]phenyl]-10-phenylanthracene;2',7'-bis[3-(9-phenylfluoren-9-yl)phenyl]-9,9'-spirobi[fluorene];9-[4-[2,7-diphenyl-9-(4-phenylphenyl)fluoren-9-yl]phenyl]-10-phenylanthracene;9-naphthalen-1-yl-10-[4-[9-(4-naphthalen-1-ylphenyl)fluoren-9-yl]phenyl]anthracene
CID 159912544
9-[3-[3-[9-[3-(3-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene;9-[3-[4-[9-[4-(3-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene;9-[4-[3-[9-[3-(4-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene
CID 159639857
2'-(10-phenylanthracen-9-yl)-7'-[4-(10-phenylanthracen-9-yl)phenyl]-9,9'-spirobi[fluorene]
CID 58174877
2',7'-bis[4-(10-phenylanthracen-9-yl)phenyl]-9,9'-spirobi[fluorene]
CID 58174873
9-[4-[3-[9-[3-(4-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene
CID 123659386
9-phenyl-10-[2,3,5,6-tetradeuterio-4-(9,9-diphenylfluoren-2-yl)phenyl]anthracene
CID 164737939
4-[9,10-bis(9,9-diphenylfluoren-2-yl)anthracen-2-yl]benzo[a]anthracene
CID 156676922
9-(9,9-diphenylfluoren-2-yl)-10-naphthalen-2-ylanthracene;9-(4-naphthalen-1-ylphenyl)-10-(4-phenylnaphthalen-1-yl)anthracene;9-(4-naphthalen-2-ylphenyl)-10-(4-phenylnaphthalen-1-yl)anthracene;9-phenanthren-9-yl-10-(4-phenylnaphthalen-1-yl)anthracene
CID 161164910
7-(4-methylphenyl)-7-phenyl-9-[10-(4-phenylphenyl)anthracen-9-yl]benzo[c]fluorene
CID 144583282
9-[4-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]phenanthrene
CID 123590616
2-[10-(4-phenylphenyl)anthracen-9-yl]spiro[fluorene-9,9'-thioxanthene]
CID 167178487

Frequently Asked Questions

What is the IUPAC name of 9-[4-[4-[9-[4-(4-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene;9-[9,9-bis(4-anthracen-9-ylphenyl)-7-(10-phenylanthracen-9-yl)fluoren-2-yl]-10-phenylanthracene;methane?
The IUPAC name of 9-[4-[4-[9-[4-(4-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene;9-[9,9-bis(4-anthracen-9-ylphenyl)-7-(10-phenylanthracen-9-yl)fluoren-2-yl]-10-phenylanthracene;methane (CID 159419556) is 9-[4-[4-[9-[4-(4-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene;9-[9,9-bis(4-anthracen-9-ylphenyl)-7-(10-phenylanthracen-9-yl)fluoren-2-yl]-10-phenylanthracene;methane.
What is the SMILES notation for 9-[4-[4-[9-[4-(4-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene;9-[9,9-bis(4-anthracen-9-ylphenyl)-7-(10-phenylanthracen-9-yl)fluoren-2-yl]-10-phenylanthracene;methane?
The canonical SMILES for 9-[4-[4-[9-[4-(4-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene;9-[9,9-bis(4-anthracen-9-ylphenyl)-7-(10-phenylanthracen-9-yl)fluoren-2-yl]-10-phenylanthracene;methane is C.c1ccc(-c2c3ccccc3c(-c3ccc4c(c3)C(c3ccc(-c5c6ccccc6cc6ccccc56)cc3)(c3ccc(-c5c6ccccc6cc6ccccc56)cc3)c3cc(-c5c6ccccc6c(-c6ccccc6)c6ccccc56)ccc3-4)c3ccccc23)cc1.c1ccc2c(c1)-c1ccccc1C2(c1ccc(-c2ccc(-c3c4ccccc4cc4ccccc34)cc2)cc1)c1ccc(-c2ccc(-c3c4ccccc4cc4ccccc34)cc2)cc1.
What is the InChIKey of 9-[4-[4-[9-[4-(4-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene;9-[9,9-bis(4-anthracen-9-ylphenyl)-7-(10-phenylanthracen-9-yl)fluoren-2-yl]-10-phenylanthracene;methane?
The InChIKey is LPOZCPADXIYXII-UHFFFAOYSA-N. The full InChI is InChI=1S/C93H58.C65H42.CH4/c1-3-23-59(24-4-1)89-77-35-15-19-39-81(77)91(82-40-20-16-36-78(82)89)67-47-53-75-76-54-48-68(92-83-41-21-17-37-79(83)90(60-25-5-2-6-26-60)80-38-18-22-42-84(80)92)58-86(76)93(85(75)57-67,69-49-43-61(44-50-69)87-71-31-11-7-27-63(71)55-64-28-8-12-32-72(64)87)70-51-45-62(46-52-70)88-73-33-13-9-29-65(73)56-66-30-10-14-34-74(66)88;1-5-17-55-49(13-1)41-50-14-2-6-18-56(50)63(55)47-29-25-43(26-30-47)45-33-37-53(38-34-45)65(61-23-11-9-21-59(61)60-22-10-12-24-62(60)65)54-39-35-46(36-40-54)44-27-31-48(32-28-44)64-57-19-7-3-15-51(57)42-52-16-4-8-20-58(52)64;/h1-58H;1-42H;1H4.
What are the key properties of 9-[4-[4-[9-[4-(4-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene;9-[9,9-bis(4-anthracen-9-ylphenyl)-7-(10-phenylanthracen-9-yl)fluoren-2-yl]-10-phenylanthracene;methane?
9-[4-[4-[9-[4-(4-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene;9-[9,9-bis(4-anthracen-9-ylphenyl)-7-(10-phenylanthracen-9-yl)fluoren-2-yl]-10-phenylanthracene;methane has a molecular weight of 2014.58 g/mol, XLogP of 43.24, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[4-[9-[4-(4-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene;9-[9,9-bis(4-anthracen-9-ylphenyl)-7-(10-phenylanthracen-9-yl)fluoren-2-yl]-10-phenylanthracene;methane is sourced from PubChem (CID 159419556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).