9-[4-[9-[4-[4-(2-diphenylphosphorylphenoxy)phenyl]phenyl]fluoren-9-yl]phenyl]carbazole

C61H42NO2P — CID 122387903

IUPAC9-[4-[9-[4-[4-(2-diphenylphosphorylphenoxy)phenyl]phenyl]fluoren-9-yl]phenyl]carbazole
SMILESO=P(c1ccccc1)(c1ccccc1)c1ccccc1Oc1ccc(-c2ccc(C3(c4ccc(-n5c6ccccc6c6ccccc65)cc4)c4ccccc4-c4ccccc43)cc2)cc1
InChIInChI=1S/C61H42NO2P/c63-65(49-17-3-1-4-18-49,50-19-5-2-6-20-50)60-30-16-15-29-59(60)64-48-41-33-44(34-42-48)43-31-35-45(36-32-43)61(55-25-11-7-21-51(55)52-22-8-12-26-56(52)61)46-37-39-47(40-38-46)62-57-27-13-9-23-53(57)54-24-10-14-28-58(54)62/h1-42H
InChIKeyAMDUYKYORHLSMY-UHFFFAOYSA-N
MW851.99 g/mol
LogP14.25
Rot. Bonds9

About 9-[4-[9-[4-[4-(2-diphenylphosphorylphenoxy)phenyl]phenyl]fluoren-9-yl]phenyl]carbazole

9-[4-[9-[4-[4-(2-diphenylphosphorylphenoxy)phenyl]phenyl]fluoren-9-yl]phenyl]carbazole (PubChem CID 122387903) has the molecular formula C61H42NO2P and a molecular weight of 851.99 g/mol. Its IUPAC name is 9-[4-[9-[4-[4-(2-diphenylphosphorylphenoxy)phenyl]phenyl]fluoren-9-yl]phenyl]carbazole.

Molecular Properties

Compound Name9-[4-[9-[4-[4-(2-diphenylphosphorylphenoxy)phenyl]phenyl]fluoren-9-yl]phenyl]carbazole
PubChem CID122387903
Molecular FormulaC61H42NO2P
Molecular Weight851.99 g/mol
Exact Mass851.30
IUPAC Name9-[4-[9-[4-[4-(2-diphenylphosphorylphenoxy)phenyl]phenyl]fluoren-9-yl]phenyl]carbazole
SMILESO=P(c1ccccc1)(c1ccccc1)c1ccccc1Oc1ccc(-c2ccc(C3(c4ccc(-n5c6ccccc6c6ccccc65)cc4)c4ccccc4-c4ccccc43)cc2)cc1
InChIInChI=1S/C61H42NO2P/c63-65(49-17-3-1-4-18-49,50-19-5-2-6-20-50)60-30-16-15-29-59(60)64-48-41-33-44(34-42-48)43-31-35-45(36-32-43)61(55-25-11-7-21-51(55)52-22-8-12-26-56(52)61)46-37-39-47(40-38-46)62-57-27-13-9-23-53(57)54-24-10-14-28-58(54)62/h1-42H
InChIKeyAMDUYKYORHLSMY-UHFFFAOYSA-N
XLogP14.25
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms65
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500851.99
LogP ≤ 514.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

9-[4-[4-[9-[4-[3-diphenylphosphoryl-4-(2-diphenylphosphorylphenoxy)phenyl]phenyl]fluoren-9-yl]phenyl]phenyl]carbazole
CID 102583872
5-[4-(4-carbazol-9-ylphenyl)phenyl]-11,11-diphenylindeno[1,2-b]carbazole
CID 168783626
3-[4-[9-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-9-yl]phenyl]-9-[3-[9-[4-[4-[9-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-9-yl]phenyl]phenyl]carbazol-3-yl]phenyl]carbazole
CID 146517009
9-[4-[9-(4-iodophenyl)fluoren-9-yl]phenyl]carbazole
CID 67326563
3-[9-[4-[3-[4-[3-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 154590573
N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-2-amine
CID 121381439
methane;9-[3-(9-phenylfluoren-9-yl)phenyl]carbazole
CID 158348177
3-[9-(9,9-diphenylfluoren-2-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 118449222
9-[4-[4-[4-[4-[3-[9-(9,9-diphenylfluoren-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]phenyl]phenyl]-3-phenyl-6-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 134354328
N,4-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N,4-diphenyl-N-[4-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]aniline;9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole
CID 158244995
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(9-phenylfluoren-9-yl)phenyl]-2-(4-phenylphenyl)aniline
CID 121381212
3-(9-phenylcarbazol-3-yl)-9-[4-[4-[3-[9-[4-(2-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]carbazole
CID 154590784

Frequently Asked Questions

What is the IUPAC name of 9-[4-[9-[4-[4-(2-diphenylphosphorylphenoxy)phenyl]phenyl]fluoren-9-yl]phenyl]carbazole?
The IUPAC name of 9-[4-[9-[4-[4-(2-diphenylphosphorylphenoxy)phenyl]phenyl]fluoren-9-yl]phenyl]carbazole (CID 122387903) is 9-[4-[9-[4-[4-(2-diphenylphosphorylphenoxy)phenyl]phenyl]fluoren-9-yl]phenyl]carbazole.
What is the SMILES notation for 9-[4-[9-[4-[4-(2-diphenylphosphorylphenoxy)phenyl]phenyl]fluoren-9-yl]phenyl]carbazole?
The canonical SMILES for 9-[4-[9-[4-[4-(2-diphenylphosphorylphenoxy)phenyl]phenyl]fluoren-9-yl]phenyl]carbazole is O=P(c1ccccc1)(c1ccccc1)c1ccccc1Oc1ccc(-c2ccc(C3(c4ccc(-n5c6ccccc6c6ccccc65)cc4)c4ccccc4-c4ccccc43)cc2)cc1.
What is the InChIKey of 9-[4-[9-[4-[4-(2-diphenylphosphorylphenoxy)phenyl]phenyl]fluoren-9-yl]phenyl]carbazole?
The InChIKey is AMDUYKYORHLSMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H42NO2P/c63-65(49-17-3-1-4-18-49,50-19-5-2-6-20-50)60-30-16-15-29-59(60)64-48-41-33-44(34-42-48)43-31-35-45(36-32-43)61(55-25-11-7-21-51(55)52-22-8-12-26-56(52)61)46-37-39-47(40-38-46)62-57-27-13-9-23-53(57)54-24-10-14-28-58(54)62/h1-42H.
What are the key properties of 9-[4-[9-[4-[4-(2-diphenylphosphorylphenoxy)phenyl]phenyl]fluoren-9-yl]phenyl]carbazole?
9-[4-[9-[4-[4-(2-diphenylphosphorylphenoxy)phenyl]phenyl]fluoren-9-yl]phenyl]carbazole has a molecular weight of 851.99 g/mol, XLogP of 14.25, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[9-[4-[4-(2-diphenylphosphorylphenoxy)phenyl]phenyl]fluoren-9-yl]phenyl]carbazole is sourced from PubChem (CID 122387903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).