7-(4-methylphenyl)-7-phenyl-9-[10-(4-phenylphenyl)anthracen-9-yl]benzo[c]fluorene

C56H38 — CID 144583282

IUPAC7-(4-methylphenyl)-7-phenyl-9-[10-(4-phenylphenyl)anthracen-9-yl]benzo[c]fluorene
SMILESCc1ccc(C2(c3ccccc3)c3cc(-c4c5ccccc5c(-c5ccc(-c6ccccc6)cc5)c5ccccc45)ccc3-c3c2ccc2ccccc32)cc1
InChIInChI=1S/C56H38/c1-37-24-32-44(33-25-37)56(43-17-6-3-7-18-43)51-35-31-40-16-8-9-19-45(40)55(51)50-34-30-42(36-52(50)56)54-48-22-12-10-20-46(48)53(47-21-11-13-23-49(47)54)41-28-26-39(27-29-41)38-14-4-2-5-15-38/h2-36H,1H3
InChIKeyZTZULBWAHIRFIL-UHFFFAOYSA-N
MW710.92 g/mol
LogP14.82
Rot. Bonds5

About 7-(4-methylphenyl)-7-phenyl-9-[10-(4-phenylphenyl)anthracen-9-yl]benzo[c]fluorene

7-(4-methylphenyl)-7-phenyl-9-[10-(4-phenylphenyl)anthracen-9-yl]benzo[c]fluorene (PubChem CID 144583282) has the molecular formula C56H38 and a molecular weight of 710.92 g/mol. Its IUPAC name is 7-(4-methylphenyl)-7-phenyl-9-[10-(4-phenylphenyl)anthracen-9-yl]benzo[c]fluorene.

Molecular Properties

Compound Name7-(4-methylphenyl)-7-phenyl-9-[10-(4-phenylphenyl)anthracen-9-yl]benzo[c]fluorene
PubChem CID144583282
Molecular FormulaC56H38
Molecular Weight710.92 g/mol
Exact Mass710.30
IUPAC Name7-(4-methylphenyl)-7-phenyl-9-[10-(4-phenylphenyl)anthracen-9-yl]benzo[c]fluorene
SMILESCc1ccc(C2(c3ccccc3)c3cc(-c4c5ccccc5c(-c5ccc(-c6ccccc6)cc5)c5ccccc45)ccc3-c3c2ccc2ccccc32)cc1
InChIInChI=1S/C56H38/c1-37-24-32-44(33-25-37)56(43-17-6-3-7-18-43)51-35-31-40-16-8-9-19-45(40)55(51)50-34-30-42(36-52(50)56)54-48-22-12-10-20-46(48)53(47-21-11-13-23-49(47)54)41-28-26-39(27-29-41)38-14-4-2-5-15-38/h2-36H,1H3
InChIKeyZTZULBWAHIRFIL-UHFFFAOYSA-N
XLogP14.82
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500710.92
LogP ≤ 514.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

9-(10-naphthalen-1-ylanthracen-9-yl)-7,7-diphenylbenzo[c]fluorene
CID 166034390
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
9-(9,9-diphenylfluoren-2-yl)-10-(4-phenylphenyl)anthracene
CID 140792270
2,7-bis[4-(3,5-diphenylphenyl)phenyl]-9,9-bis(4-methylphenyl)fluorene;2,7-bis[4-(3,5-diphenylphenyl)phenyl]-9,9-diphenylfluorene;2,7-bis[4-(3,5-diphenylphenyl)phenyl]-9-(4-methylphenyl)-9-(4-phenylphenyl)fluorene;4-[9-(4-methylphenyl)-9-naphthalen-1-yl-7-pyren-4-ylfluoren-2-yl]pyrene
CID 157226056
9-methyl-5-(4-naphthalen-2-ylphenyl)-7,7-diphenylbenzo[c]fluorene
CID 59755354
9-[4-(4-methylphenyl)phenyl]-9-phenyl-2,7-bis(4-phenylphenyl)fluorene
CID 58894820
9-[4-(4-methylphenyl)phenyl]-2,7-dinaphthalen-2-yl-9-phenylfluorene
CID 58894843
7,7-diphenylbenzo[g]fluoren-9-amine
CID 134361009
N-[4-[4-(7,7-diphenylbenzo[g]fluoren-9-yl)phenyl]phenyl]-N,2-diphenylaniline
CID 135299735
4-[9,9-bis(4-methylphenyl)-7-pyren-4-ylfluoren-2-yl]pyrene
CID 58795266
9-phenanthren-9-yl-5,7,7-triphenylbenzo[c]fluorene
CID 59755306
N-[4-(7,7-diphenylbenzo[g]fluoren-9-yl)phenyl]-4-(4-fluorophenyl)-N-phenylaniline
CID 135299717

Frequently Asked Questions

What is the IUPAC name of 7-(4-methylphenyl)-7-phenyl-9-[10-(4-phenylphenyl)anthracen-9-yl]benzo[c]fluorene?
The IUPAC name of 7-(4-methylphenyl)-7-phenyl-9-[10-(4-phenylphenyl)anthracen-9-yl]benzo[c]fluorene (CID 144583282) is 7-(4-methylphenyl)-7-phenyl-9-[10-(4-phenylphenyl)anthracen-9-yl]benzo[c]fluorene.
What is the SMILES notation for 7-(4-methylphenyl)-7-phenyl-9-[10-(4-phenylphenyl)anthracen-9-yl]benzo[c]fluorene?
The canonical SMILES for 7-(4-methylphenyl)-7-phenyl-9-[10-(4-phenylphenyl)anthracen-9-yl]benzo[c]fluorene is Cc1ccc(C2(c3ccccc3)c3cc(-c4c5ccccc5c(-c5ccc(-c6ccccc6)cc5)c5ccccc45)ccc3-c3c2ccc2ccccc32)cc1.
What is the InChIKey of 7-(4-methylphenyl)-7-phenyl-9-[10-(4-phenylphenyl)anthracen-9-yl]benzo[c]fluorene?
The InChIKey is ZTZULBWAHIRFIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H38/c1-37-24-32-44(33-25-37)56(43-17-6-3-7-18-43)51-35-31-40-16-8-9-19-45(40)55(51)50-34-30-42(36-52(50)56)54-48-22-12-10-20-46(48)53(47-21-11-13-23-49(47)54)41-28-26-39(27-29-41)38-14-4-2-5-15-38/h2-36H,1H3.
What are the key properties of 7-(4-methylphenyl)-7-phenyl-9-[10-(4-phenylphenyl)anthracen-9-yl]benzo[c]fluorene?
7-(4-methylphenyl)-7-phenyl-9-[10-(4-phenylphenyl)anthracen-9-yl]benzo[c]fluorene has a molecular weight of 710.92 g/mol, XLogP of 14.82, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-methylphenyl)-7-phenyl-9-[10-(4-phenylphenyl)anthracen-9-yl]benzo[c]fluorene is sourced from PubChem (CID 144583282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).