9-[6-(9,9-dimethyl-7-phenylfluoren-2-yl)naphthalen-2-yl]-10-(4-naphthalen-1-ylphenyl)anthracene;9-[3-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;9-[4-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;2'-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-7'-phenyl-9,9'-spirobi[fluorene];2'-phenyl-7'-[3-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-9,9'-spirobi[fluorene]

C287H192 — CID 157440503

IUPAC9-[6-(9,9-dimethyl-7-phenylfluoren-2-yl)naphthalen-2-yl]-10-(4-naphthalen-1-ylphenyl)anthracene;9-[3-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;9-[4-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;2'-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-7'-phenyl-9,9'-spirobi[fluorene];2'-phenyl-7'-[3-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-9,9'-spirobi[fluorene]
SMILESCC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(-c3ccc(-c4c5ccccc5c(-c5ccc6ccccc6c5)c5ccccc45)cc3)cc21.CC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(-c3ccc4cc(-c5c6ccccc6c(-c6ccc(-c7cccc8ccccc78)cc6)c6ccccc56)ccc4c3)cc21.CC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(-c3cccc(-c4c5ccccc5c(-c5ccc6ccccc6c5)c5ccccc45)c3)cc21.c1ccc(-c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2cc(-c4cccc(-c5c6ccccc6c(-c6ccc7ccccc7c6)c6ccccc56)c4)ccc2-3)cc1.c1ccc(-c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2cc(-c4cccc(-c5c6ccccc6c(-c6ccccc6-c6ccccc6)c6ccccc56)c4)ccc2-3)cc1
InChIInChI=1S/C63H40.C61H38.C61H42.2C51H36/c1-3-18-41(19-4-1)44-34-36-50-51-37-35-45(40-60(51)63(59(50)39-44)57-32-15-13-25-48(57)49-26-14-16-33-58(49)63)43-22-17-23-46(38-43)61-53-28-9-11-30-55(53)62(56-31-12-10-29-54(56)61)52-27-8-7-24-47(52)42-20-5-2-6-21-42;1-2-15-39(16-3-1)43-31-33-49-50-34-32-44(38-58(50)61(57(49)37-43)55-27-12-10-21-47(55)48-22-11-13-28-56(48)61)42-19-14-20-45(36-42)59-51-23-6-8-25-53(51)60(54-26-9-7-24-52(54)59)46-30-29-40-17-4-5-18-41(40)35-46;1-61(2)57-37-46(39-13-4-3-5-14-39)31-33-51(57)52-34-32-47(38-58(52)61)44-27-28-45-36-48(30-29-43(45)35-44)60-55-20-10-8-18-53(55)59(54-19-9-11-21-56(54)60)42-25-23-41(24-26-42)50-22-12-16-40-15-6-7-17-49(40)50;1-51(2)47-31-37(33-13-4-3-5-14-33)25-27-41(47)42-28-26-38(32-48(42)51)36-17-12-18-39(30-36)49-43-19-8-10-21-45(43)50(46-22-11-9-20-44(46)49)40-24-23-34-15-6-7-16-35(34)29-40;1-51(2)47-31-38(33-12-4-3-5-13-33)26-28-41(47)42-29-27-39(32-48(42)51)35-20-23-36(24-21-35)49-43-16-8-10-18-45(43)50(46-19-11-9-17-44(46)49)40-25-22-34-14-6-7-15-37(34)30-40/h1-40H;1-38H;3-38H,1-2H3;2*3-32H,1-2H3
InChIKeyBRPSZLITYQBUDT-UHFFFAOYSA-N
MW3640.69 g/mol
LogP78.01
Rot. Bonds22

About 9-[6-(9,9-dimethyl-7-phenylfluoren-2-yl)naphthalen-2-yl]-10-(4-naphthalen-1-ylphenyl)anthracene;9-[3-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;9-[4-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;2'-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-7'-phenyl-9,9'-spirobi[fluorene];2'-phenyl-7'-[3-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-9,9'-spirobi[fluorene]

9-[6-(9,9-dimethyl-7-phenylfluoren-2-yl)naphthalen-2-yl]-10-(4-naphthalen-1-ylphenyl)anthracene;9-[3-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;9-[4-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;2'-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-7'-phenyl-9,9'-spirobi[fluorene];2'-phenyl-7'-[3-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-9,9'-spirobi[fluorene] (PubChem CID 157440503) has the molecular formula C287H192 and a molecular weight of 3640.69 g/mol. Its IUPAC name is 9-[6-(9,9-dimethyl-7-phenylfluoren-2-yl)naphthalen-2-yl]-10-(4-naphthalen-1-ylphenyl)anthracene;9-[3-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;9-[4-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;2'-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-7'-phenyl-9,9'-spirobi[fluorene];2'-phenyl-7'-[3-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-9,9'-spirobi[fluorene].

Molecular Properties

Compound Name9-[6-(9,9-dimethyl-7-phenylfluoren-2-yl)naphthalen-2-yl]-10-(4-naphthalen-1-ylphenyl)anthracene;9-[3-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;9-[4-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;2'-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-7'-phenyl-9,9'-spirobi[fluorene];2'-phenyl-7'-[3-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-9,9'-spirobi[fluorene]
PubChem CID157440503
Molecular FormulaC287H192
Molecular Weight3640.69 g/mol
Exact Mass3637.50
IUPAC Name9-[6-(9,9-dimethyl-7-phenylfluoren-2-yl)naphthalen-2-yl]-10-(4-naphthalen-1-ylphenyl)anthracene;9-[3-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;9-[4-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;2'-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-7'-phenyl-9,9'-spirobi[fluorene];2'-phenyl-7'-[3-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-9,9'-spirobi[fluorene]
SMILESCC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(-c3ccc(-c4c5ccccc5c(-c5ccc6ccccc6c5)c5ccccc45)cc3)cc21.CC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(-c3ccc4cc(-c5c6ccccc6c(-c6ccc(-c7cccc8ccccc78)cc6)c6ccccc56)ccc4c3)cc21.CC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(-c3cccc(-c4c5ccccc5c(-c5ccc6ccccc6c5)c5ccccc45)c3)cc21.c1ccc(-c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2cc(-c4cccc(-c5c6ccccc6c(-c6ccc7ccccc7c6)c6ccccc56)c4)ccc2-3)cc1.c1ccc(-c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2cc(-c4cccc(-c5c6ccccc6c(-c6ccccc6-c6ccccc6)c6ccccc56)c4)ccc2-3)cc1
InChIInChI=1S/C63H40.C61H38.C61H42.2C51H36/c1-3-18-41(19-4-1)44-34-36-50-51-37-35-45(40-60(51)63(59(50)39-44)57-32-15-13-25-48(57)49-26-14-16-33-58(49)63)43-22-17-23-46(38-43)61-53-28-9-11-30-55(53)62(56-31-12-10-29-54(56)61)52-27-8-7-24-47(52)42-20-5-2-6-21-42;1-2-15-39(16-3-1)43-31-33-49-50-34-32-44(38-58(50)61(57(49)37-43)55-27-12-10-21-47(55)48-22-11-13-28-56(48)61)42-19-14-20-45(36-42)59-51-23-6-8-25-53(51)60(54-26-9-7-24-52(54)59)46-30-29-40-17-4-5-18-41(40)35-46;1-61(2)57-37-46(39-13-4-3-5-14-39)31-33-51(57)52-34-32-47(38-58(52)61)44-27-28-45-36-48(30-29-43(45)35-44)60-55-20-10-8-18-53(55)59(54-19-9-11-21-56(54)60)42-25-23-41(24-26-42)50-22-12-16-40-15-6-7-17-49(40)50;1-51(2)47-31-37(33-13-4-3-5-14-33)25-27-41(47)42-28-26-38(32-48(42)51)36-17-12-18-39(30-36)49-43-19-8-10-21-45(43)50(46-22-11-9-20-44(46)49)40-24-23-34-15-6-7-16-35(34)29-40;1-51(2)47-31-38(33-12-4-3-5-13-33)26-28-41(47)42-29-27-39(32-48(42)51)35-20-23-36(24-21-35)49-43-16-8-10-18-45(43)50(46-19-11-9-17-44(46)49)40-25-22-34-14-6-7-15-37(34)30-40/h1-40H;1-38H;3-38H,1-2H3;2*3-32H,1-2H3
InChIKeyBRPSZLITYQBUDT-UHFFFAOYSA-N
XLogP78.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds22
Heavy Atoms287
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003640.69
LogP ≤ 578.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 9-[6-(9,9-dimethyl-7-phenylfluoren-2-yl)naphthalen-2-yl]-10-(4-naphthalen-1-ylphenyl)anthracene;9-[3-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;9-[4-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;2'-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-7'-phenyl-9,9'-spirobi[fluorene];2'-phenyl-7'-[3-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-9,9'-spirobi[fluorene] with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-[6-(9,9-dimethyl-7-phenylfluoren-2-yl)naphthalen-2-yl]-10-(4-naphthalen-1-ylphenyl)anthracene;9-[3-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;9-[4-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;2'-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-7'-phenyl-9,9'-spirobi[fluorene];2'-phenyl-7'-[3-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-9,9'-spirobi[fluorene]?
The IUPAC name of 9-[6-(9,9-dimethyl-7-phenylfluoren-2-yl)naphthalen-2-yl]-10-(4-naphthalen-1-ylphenyl)anthracene;9-[3-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;9-[4-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;2'-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-7'-phenyl-9,9'-spirobi[fluorene];2'-phenyl-7'-[3-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-9,9'-spirobi[fluorene] (CID 157440503) is 9-[6-(9,9-dimethyl-7-phenylfluoren-2-yl)naphthalen-2-yl]-10-(4-naphthalen-1-ylphenyl)anthracene;9-[3-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;9-[4-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;2'-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-7'-phenyl-9,9'-spirobi[fluorene];2'-phenyl-7'-[3-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-9,9'-spirobi[fluorene].
What is the SMILES notation for 9-[6-(9,9-dimethyl-7-phenylfluoren-2-yl)naphthalen-2-yl]-10-(4-naphthalen-1-ylphenyl)anthracene;9-[3-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;9-[4-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;2'-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-7'-phenyl-9,9'-spirobi[fluorene];2'-phenyl-7'-[3-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-9,9'-spirobi[fluorene]?
The canonical SMILES for 9-[6-(9,9-dimethyl-7-phenylfluoren-2-yl)naphthalen-2-yl]-10-(4-naphthalen-1-ylphenyl)anthracene;9-[3-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;9-[4-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;2'-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-7'-phenyl-9,9'-spirobi[fluorene];2'-phenyl-7'-[3-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-9,9'-spirobi[fluorene] is CC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(-c3ccc(-c4c5ccccc5c(-c5ccc6ccccc6c5)c5ccccc45)cc3)cc21.CC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(-c3ccc4cc(-c5c6ccccc6c(-c6ccc(-c7cccc8ccccc78)cc6)c6ccccc56)ccc4c3)cc21.CC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(-c3cccc(-c4c5ccccc5c(-c5ccc6ccccc6c5)c5ccccc45)c3)cc21.c1ccc(-c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2cc(-c4cccc(-c5c6ccccc6c(-c6ccc7ccccc7c6)c6ccccc56)c4)ccc2-3)cc1.c1ccc(-c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2cc(-c4cccc(-c5c6ccccc6c(-c6ccccc6-c6ccccc6)c6ccccc56)c4)ccc2-3)cc1.
What is the InChIKey of 9-[6-(9,9-dimethyl-7-phenylfluoren-2-yl)naphthalen-2-yl]-10-(4-naphthalen-1-ylphenyl)anthracene;9-[3-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;9-[4-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;2'-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-7'-phenyl-9,9'-spirobi[fluorene];2'-phenyl-7'-[3-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-9,9'-spirobi[fluorene]?
The InChIKey is BRPSZLITYQBUDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H40.C61H38.C61H42.2C51H36/c1-3-18-41(19-4-1)44-34-36-50-51-37-35-45(40-60(51)63(59(50)39-44)57-32-15-13-25-48(57)49-26-14-16-33-58(49)63)43-22-17-23-46(38-43)61-53-28-9-11-30-55(53)62(56-31-12-10-29-54(56)61)52-27-8-7-24-47(52)42-20-5-2-6-21-42;1-2-15-39(16-3-1)43-31-33-49-50-34-32-44(38-58(50)61(57(49)37-43)55-27-12-10-21-47(55)48-22-11-13-28-56(48)61)42-19-14-20-45(36-42)59-51-23-6-8-25-53(51)60(54-26-9-7-24-52(54)59)46-30-29-40-17-4-5-18-41(40)35-46;1-61(2)57-37-46(39-13-4-3-5-14-39)31-33-51(57)52-34-32-47(38-58(52)61)44-27-28-45-36-48(30-29-43(45)35-44)60-55-20-10-8-18-53(55)59(54-19-9-11-21-56(54)60)42-25-23-41(24-26-42)50-22-12-16-40-15-6-7-17-49(40)50;1-51(2)47-31-37(33-13-4-3-5-14-33)25-27-41(47)42-28-26-38(32-48(42)51)36-17-12-18-39(30-36)49-43-19-8-10-21-45(43)50(46-22-11-9-20-44(46)49)40-24-23-34-15-6-7-16-35(34)29-40;1-51(2)47-31-38(33-12-4-3-5-13-33)26-28-41(47)42-29-27-39(32-48(42)51)35-20-23-36(24-21-35)49-43-16-8-10-18-45(43)50(46-19-11-9-17-44(46)49)40-25-22-34-14-6-7-15-37(34)30-40/h1-40H;1-38H;3-38H,1-2H3;2*3-32H,1-2H3.
What are the key properties of 9-[6-(9,9-dimethyl-7-phenylfluoren-2-yl)naphthalen-2-yl]-10-(4-naphthalen-1-ylphenyl)anthracene;9-[3-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;9-[4-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;2'-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-7'-phenyl-9,9'-spirobi[fluorene];2'-phenyl-7'-[3-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-9,9'-spirobi[fluorene]?
9-[6-(9,9-dimethyl-7-phenylfluoren-2-yl)naphthalen-2-yl]-10-(4-naphthalen-1-ylphenyl)anthracene;9-[3-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;9-[4-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;2'-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-7'-phenyl-9,9'-spirobi[fluorene];2'-phenyl-7'-[3-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-9,9'-spirobi[fluorene] has a molecular weight of 3640.69 g/mol, XLogP of 78.01, 22 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[6-(9,9-dimethyl-7-phenylfluoren-2-yl)naphthalen-2-yl]-10-(4-naphthalen-1-ylphenyl)anthracene;9-[3-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;9-[4-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene;2'-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-7'-phenyl-9,9'-spirobi[fluorene];2'-phenyl-7'-[3-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-9,9'-spirobi[fluorene] is sourced from PubChem (CID 157440503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).