9-(7-naphthalen-1-yl-9,9-diphenylfluoren-2-yl)-3,6-bis(4-phenanthren-9-ylphenyl)carbazole

C87H55N — CID 118475186

IUPAC9-(7-naphthalen-1-yl-9,9-diphenylfluoren-2-yl)-3,6-bis(4-phenanthren-9-ylphenyl)carbazole
SMILESc1ccc(C2(c3ccccc3)c3cc(-c4cccc5ccccc45)ccc3-c3ccc(-n4c5ccc(-c6ccc(-c7cc8ccccc8c8ccccc78)cc6)cc5c5cc(-c6ccc(-c7cc8ccccc8c8ccccc78)cc6)ccc54)cc32)cc1
InChIInChI=1S/C87H55N/c1-3-22-66(23-4-1)87(67-24-5-2-6-25-67)83-54-65(70-33-17-21-58-18-7-10-26-69(58)70)42-46-77(83)78-47-45-68(55-84(78)87)88-85-48-43-61(56-34-38-59(39-35-56)79-52-63-19-8-11-27-71(63)73-29-13-15-31-75(73)79)50-81(85)82-51-62(44-49-86(82)88)57-36-40-60(41-37-57)80-53-64-20-9-12-28-72(64)74-30-14-16-32-76(74)80/h1-55H
InChIKeyAHZIWFFVVFCGQD-UHFFFAOYSA-N
MW1114.40 g/mol
LogP23.25
Rot. Bonds8

About 9-(7-naphthalen-1-yl-9,9-diphenylfluoren-2-yl)-3,6-bis(4-phenanthren-9-ylphenyl)carbazole

9-(7-naphthalen-1-yl-9,9-diphenylfluoren-2-yl)-3,6-bis(4-phenanthren-9-ylphenyl)carbazole (PubChem CID 118475186) has the molecular formula C87H55N and a molecular weight of 1114.40 g/mol. Its IUPAC name is 9-(7-naphthalen-1-yl-9,9-diphenylfluoren-2-yl)-3,6-bis(4-phenanthren-9-ylphenyl)carbazole.

Molecular Properties

Compound Name9-(7-naphthalen-1-yl-9,9-diphenylfluoren-2-yl)-3,6-bis(4-phenanthren-9-ylphenyl)carbazole
PubChem CID118475186
Molecular FormulaC87H55N
Molecular Weight1114.40 g/mol
Exact Mass1113.43
IUPAC Name9-(7-naphthalen-1-yl-9,9-diphenylfluoren-2-yl)-3,6-bis(4-phenanthren-9-ylphenyl)carbazole
SMILESc1ccc(C2(c3ccccc3)c3cc(-c4cccc5ccccc45)ccc3-c3ccc(-n4c5ccc(-c6ccc(-c7cc8ccccc8c8ccccc78)cc6)cc5c5cc(-c6ccc(-c7cc8ccccc8c8ccccc78)cc6)ccc54)cc32)cc1
InChIInChI=1S/C87H55N/c1-3-22-66(23-4-1)87(67-24-5-2-6-25-67)83-54-65(70-33-17-21-58-18-7-10-26-69(58)70)42-46-77(83)78-47-45-68(55-84(78)87)88-85-48-43-61(56-34-38-59(39-35-56)79-52-63-19-8-11-27-71(63)73-29-13-15-31-75(73)79)50-81(85)82-51-62(44-49-86(82)88)57-36-40-60(41-37-57)80-53-64-20-9-12-28-72(64)74-30-14-16-32-76(74)80/h1-55H
InChIKeyAHZIWFFVVFCGQD-UHFFFAOYSA-N
XLogP23.25
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms88
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001114.40
LogP ≤ 523.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

9-(7-naphthalen-1-yl-9,9-diphenylfluoren-2-yl)-3,6-bis[4-(4-phenanthren-9-ylphenyl)phenyl]carbazole
CID 118475183
9-(9,9-dimethyl-7-naphthalen-1-ylfluoren-2-yl)-3,6-bis(4-phenanthren-9-ylphenyl)carbazole
CID 118475197
9-phenanthren-9-yl-11,11-diphenyl-5-(4-phenylphenyl)indeno[1,2-b]carbazole
CID 87412983
3,5-bis(4-naphthalen-1-ylphenyl)-1-(7,9,9-triphenylfluoren-2-yl)indole
CID 126620415
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
3-[4-[9,9-diphenyl-7-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-yl]phenyl]-9-phenylcarbazole
CID 89118693
9,9-diphenyl-N-(6-phenylnaphthalen-2-yl)-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]fluoren-2-amine;N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]fluoren-2-amine
CID 159629958
3-(4-benzylphenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole
CID 159140546
9-(9,9-dimethylfluoren-2-yl)-3,6-di(phenanthren-9-yl)carbazole
CID 118475067
3-(4-benzylphenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole;3-(4-benzylphenyl)-9-(9,9'-spirobi[fluorene]-2-yl)carbazole
CID 159140544
3,6-bis[4-[3,6-bis(9,9-diphenylfluoren-2-yl)carbazol-9-yl]phenyl]-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole
CID 59306581

Frequently Asked Questions

What is the IUPAC name of 9-(7-naphthalen-1-yl-9,9-diphenylfluoren-2-yl)-3,6-bis(4-phenanthren-9-ylphenyl)carbazole?
The IUPAC name of 9-(7-naphthalen-1-yl-9,9-diphenylfluoren-2-yl)-3,6-bis(4-phenanthren-9-ylphenyl)carbazole (CID 118475186) is 9-(7-naphthalen-1-yl-9,9-diphenylfluoren-2-yl)-3,6-bis(4-phenanthren-9-ylphenyl)carbazole.
What is the SMILES notation for 9-(7-naphthalen-1-yl-9,9-diphenylfluoren-2-yl)-3,6-bis(4-phenanthren-9-ylphenyl)carbazole?
The canonical SMILES for 9-(7-naphthalen-1-yl-9,9-diphenylfluoren-2-yl)-3,6-bis(4-phenanthren-9-ylphenyl)carbazole is c1ccc(C2(c3ccccc3)c3cc(-c4cccc5ccccc45)ccc3-c3ccc(-n4c5ccc(-c6ccc(-c7cc8ccccc8c8ccccc78)cc6)cc5c5cc(-c6ccc(-c7cc8ccccc8c8ccccc78)cc6)ccc54)cc32)cc1.
What is the InChIKey of 9-(7-naphthalen-1-yl-9,9-diphenylfluoren-2-yl)-3,6-bis(4-phenanthren-9-ylphenyl)carbazole?
The InChIKey is AHZIWFFVVFCGQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C87H55N/c1-3-22-66(23-4-1)87(67-24-5-2-6-25-67)83-54-65(70-33-17-21-58-18-7-10-26-69(58)70)42-46-77(83)78-47-45-68(55-84(78)87)88-85-48-43-61(56-34-38-59(39-35-56)79-52-63-19-8-11-27-71(63)73-29-13-15-31-75(73)79)50-81(85)82-51-62(44-49-86(82)88)57-36-40-60(41-37-57)80-53-64-20-9-12-28-72(64)74-30-14-16-32-76(74)80/h1-55H.
What are the key properties of 9-(7-naphthalen-1-yl-9,9-diphenylfluoren-2-yl)-3,6-bis(4-phenanthren-9-ylphenyl)carbazole?
9-(7-naphthalen-1-yl-9,9-diphenylfluoren-2-yl)-3,6-bis(4-phenanthren-9-ylphenyl)carbazole has a molecular weight of 1114.40 g/mol, XLogP of 23.25, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(7-naphthalen-1-yl-9,9-diphenylfluoren-2-yl)-3,6-bis(4-phenanthren-9-ylphenyl)carbazole is sourced from PubChem (CID 118475186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).