9-phenyl-10-[4-[6-[4-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]phenyl]anthracene

C62H40 — CID 59024577

IUPAC9-phenyl-10-[4-[6-[4-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]phenyl]anthracene
SMILESc1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5cc(-c6ccc(-c7c8ccccc8c(-c8ccccc8)c8ccccc78)cc6)ccc5c4)cc3)c3ccccc23)cc1
InChIInChI=1S/C62H40/c1-3-15-43(16-4-1)59-51-19-7-11-23-55(51)61(56-24-12-8-20-52(56)59)45-31-27-41(28-32-45)47-35-37-50-40-48(36-38-49(50)39-47)42-29-33-46(34-30-42)62-57-25-13-9-21-53(57)60(44-17-5-2-6-18-44)54-22-10-14-26-58(54)62/h1-40H
InChIKeyFGYFKXPYTQEKRM-UHFFFAOYSA-N
MW785.00 g/mol
LogP17.45
Rot. Bonds6

About 9-phenyl-10-[4-[6-[4-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]phenyl]anthracene

9-phenyl-10-[4-[6-[4-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]phenyl]anthracene (PubChem CID 59024577) has the molecular formula C62H40 and a molecular weight of 785.00 g/mol. Its IUPAC name is 9-phenyl-10-[4-[6-[4-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]phenyl]anthracene.

Molecular Properties

Compound Name9-phenyl-10-[4-[6-[4-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]phenyl]anthracene
PubChem CID59024577
Molecular FormulaC62H40
Molecular Weight785.00 g/mol
Exact Mass784.31
IUPAC Name9-phenyl-10-[4-[6-[4-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]phenyl]anthracene
SMILESc1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5cc(-c6ccc(-c7c8ccccc8c(-c8ccccc8)c8ccccc78)cc6)ccc5c4)cc3)c3ccccc23)cc1
InChIInChI=1S/C62H40/c1-3-15-43(16-4-1)59-51-19-7-11-23-55(51)61(56-24-12-8-20-52(56)59)45-31-27-41(28-32-45)47-35-37-50-40-48(36-38-49(50)39-47)42-29-33-46(34-30-42)62-57-25-13-9-21-53(57)60(44-17-5-2-6-18-44)54-22-10-14-26-58(54)62/h1-40H
InChIKeyFGYFKXPYTQEKRM-UHFFFAOYSA-N
XLogP17.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500785.00
LogP ≤ 517.45
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-phenyl-10-[4-[4-[6-[4-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]phenyl]phenyl]anthracene
CID 59024571
9-naphthalen-2-yl-10-[7-[7-[4-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]naphthalen-2-yl]anthracene
CID 172546716
9-(3-phenylphenyl)-10-[6-[10-(3-phenylphenyl)anthracen-9-yl]naphthalen-2-yl]anthracene
CID 153438367
9,10-dinaphthalen-2-ylanthracene;9-naphthalen-2-yl-10-(6-phenylnaphthalen-2-yl)anthracene
CID 143848431
9-(4-naphthalen-2-ylphenyl)-10-(3-phenylphenyl)anthracene
CID 58151267
9-(3-naphthalen-2-ylphenyl)-10-[4-(4-phenylphenyl)phenyl]anthracene
CID 144568868
9-[6-(3-naphthalen-2-yl-5-phenylphenyl)naphthalen-2-yl]-10-phenylanthracene
CID 58590127
9-(4-naphthalen-2-ylphenyl)-10-[3-(3-phenylphenyl)phenyl]anthracene
CID 144568832
9,10-bis(3-naphthalen-2-yl-5-phenylphenyl)anthracene
CID 59557528
9-naphthalen-2-yl-10-(4-naphthalen-2-ylphenyl)anthracene
CID 21022512
9-naphthalen-2-yl-10-[4-(10-phenylanthracen-9-yl)phenyl]anthracene
CID 58876197
9-(3,5-diphenylphenyl)-10-phenylanthracene;9-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-10-phenylanthracene;9-phenyl-10-[4-(4-phenylphenyl)phenyl]anthracene
CID 161401825

Frequently Asked Questions

What is the IUPAC name of 9-phenyl-10-[4-[6-[4-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]phenyl]anthracene?
The IUPAC name of 9-phenyl-10-[4-[6-[4-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]phenyl]anthracene (CID 59024577) is 9-phenyl-10-[4-[6-[4-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]phenyl]anthracene.
What is the SMILES notation for 9-phenyl-10-[4-[6-[4-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]phenyl]anthracene?
The canonical SMILES for 9-phenyl-10-[4-[6-[4-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]phenyl]anthracene is c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5cc(-c6ccc(-c7c8ccccc8c(-c8ccccc8)c8ccccc78)cc6)ccc5c4)cc3)c3ccccc23)cc1.
What is the InChIKey of 9-phenyl-10-[4-[6-[4-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]phenyl]anthracene?
The InChIKey is FGYFKXPYTQEKRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H40/c1-3-15-43(16-4-1)59-51-19-7-11-23-55(51)61(56-24-12-8-20-52(56)59)45-31-27-41(28-32-45)47-35-37-50-40-48(36-38-49(50)39-47)42-29-33-46(34-30-42)62-57-25-13-9-21-53(57)60(44-17-5-2-6-18-44)54-22-10-14-26-58(54)62/h1-40H.
What are the key properties of 9-phenyl-10-[4-[6-[4-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]phenyl]anthracene?
9-phenyl-10-[4-[6-[4-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]phenyl]anthracene has a molecular weight of 785.00 g/mol, XLogP of 17.45, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-10-[4-[6-[4-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]phenyl]anthracene is sourced from PubChem (CID 59024577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).