9-naphthalen-2-yl-10-[4-[9-(4-naphthalen-1-ylphenyl)fluoren-9-yl]phenyl]anthracene

C59H38 — CID 123292733

IUPAC9-naphthalen-2-yl-10-[4-[9-(4-naphthalen-1-ylphenyl)fluoren-9-yl]phenyl]anthracene
SMILESc1ccc2c(c1)-c1ccccc1C2(c1ccc(-c2cccc3ccccc23)cc1)c1ccc(-c2c3ccccc3c(-c3ccc4ccccc4c3)c3ccccc23)cc1
InChIInChI=1S/C59H38/c1-2-16-43-38-44(29-28-39(43)14-1)58-53-23-7-5-21-51(53)57(52-22-6-8-24-54(52)58)42-32-36-46(37-33-42)59(55-26-11-9-19-49(55)50-20-10-12-27-56(50)59)45-34-30-41(31-35-45)48-25-13-17-40-15-3-4-18-47(40)48/h1-38H
InChIKeyVPTDGTYSWOLBAL-UHFFFAOYSA-N
MW746.95 g/mol
LogP15.66
Rot. Bonds5

About 9-naphthalen-2-yl-10-[4-[9-(4-naphthalen-1-ylphenyl)fluoren-9-yl]phenyl]anthracene

9-naphthalen-2-yl-10-[4-[9-(4-naphthalen-1-ylphenyl)fluoren-9-yl]phenyl]anthracene (PubChem CID 123292733) has the molecular formula C59H38 and a molecular weight of 746.95 g/mol. Its IUPAC name is 9-naphthalen-2-yl-10-[4-[9-(4-naphthalen-1-ylphenyl)fluoren-9-yl]phenyl]anthracene.

Molecular Properties

Compound Name9-naphthalen-2-yl-10-[4-[9-(4-naphthalen-1-ylphenyl)fluoren-9-yl]phenyl]anthracene
PubChem CID123292733
Molecular FormulaC59H38
Molecular Weight746.95 g/mol
Exact Mass746.30
IUPAC Name9-naphthalen-2-yl-10-[4-[9-(4-naphthalen-1-ylphenyl)fluoren-9-yl]phenyl]anthracene
SMILESc1ccc2c(c1)-c1ccccc1C2(c1ccc(-c2cccc3ccccc23)cc1)c1ccc(-c2c3ccccc3c(-c3ccc4ccccc4c3)c3ccccc23)cc1
InChIInChI=1S/C59H38/c1-2-16-43-38-44(29-28-39(43)14-1)58-53-23-7-5-21-51(53)57(52-22-6-8-24-54(52)58)42-32-36-46(37-33-42)59(55-26-11-9-19-49(55)50-20-10-12-27-56(50)59)45-34-30-41(31-35-45)48-25-13-17-40-15-3-4-18-47(40)48/h1-38H
InChIKeyVPTDGTYSWOLBAL-UHFFFAOYSA-N
XLogP15.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms59
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500746.95
LogP ≤ 515.66
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-(9,9-diphenylfluoren-2-yl)-10-naphthalen-2-ylanthracene;9-(4-naphthalen-1-ylphenyl)-10-(4-phenylnaphthalen-1-yl)anthracene;9-(4-naphthalen-2-ylphenyl)-10-(4-phenylnaphthalen-1-yl)anthracene;9-phenanthren-9-yl-10-(4-phenylnaphthalen-1-yl)anthracene
CID 161164910
9-(7-naphthalen-2-ylnaphthalen-2-yl)-10-(4-naphthalen-1-ylphenyl)anthracene
CID 123979832
9-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-10-(4-naphthalen-1-ylphenyl)anthracene
CID 58856463
9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]anthracene;9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]anthracene
CID 160960650
9-(4-naphthalen-1-ylphenyl)-10-(4-naphthalen-2-ylphenyl)anthracene;9-(4-naphthalen-1-ylphenyl)-10-[3-(4-naphthalen-2-ylphenyl)phenyl]anthracene
CID 159854260
7'-(10-naphthalen-2-ylanthracen-9-yl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaene]
CID 140962634
5-(10-naphthalen-2-ylanthracen-9-yl)-7,7-diphenylbenzo[c]fluorene
CID 166034549
9-(3-naphthalen-2-ylphenyl)-10-[6-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]anthracene
CID 123921245
6-(10-naphthalen-2-ylanthracen-9-yl)spiro[benzo[a]fluorene-11,9'-fluorene]
CID 166034510
9-[4-[9-(4-methylphenyl)fluoren-9-yl]phenyl]-10-[4-[(E)-2-(4-naphthalen-2-ylphenyl)ethenyl]phenyl]anthracene
CID 140834704
9-[4-[9-(4-methylphenyl)fluoren-9-yl]phenyl]-10-[4-[2-(4-naphthalen-2-ylphenyl)ethenyl]phenyl]anthracene
CID 123212065
N-[4-[10-[4-(dinaphthalen-1-ylamino)phenyl]anthracen-9-yl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;N-[4-[9-[4-(dinaphthalen-2-ylamino)phenyl]fluoren-9-yl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine;N-naphthalen-1-yl-N-[4-[10-[4-[naphthalen-1-yl(naphthalen-2-yl)amino]phenyl]anthracen-9-yl]phenyl]naphthalen-2-amine
CID 161106636

Frequently Asked Questions

What is the IUPAC name of 9-naphthalen-2-yl-10-[4-[9-(4-naphthalen-1-ylphenyl)fluoren-9-yl]phenyl]anthracene?
The IUPAC name of 9-naphthalen-2-yl-10-[4-[9-(4-naphthalen-1-ylphenyl)fluoren-9-yl]phenyl]anthracene (CID 123292733) is 9-naphthalen-2-yl-10-[4-[9-(4-naphthalen-1-ylphenyl)fluoren-9-yl]phenyl]anthracene.
What is the SMILES notation for 9-naphthalen-2-yl-10-[4-[9-(4-naphthalen-1-ylphenyl)fluoren-9-yl]phenyl]anthracene?
The canonical SMILES for 9-naphthalen-2-yl-10-[4-[9-(4-naphthalen-1-ylphenyl)fluoren-9-yl]phenyl]anthracene is c1ccc2c(c1)-c1ccccc1C2(c1ccc(-c2cccc3ccccc23)cc1)c1ccc(-c2c3ccccc3c(-c3ccc4ccccc4c3)c3ccccc23)cc1.
What is the InChIKey of 9-naphthalen-2-yl-10-[4-[9-(4-naphthalen-1-ylphenyl)fluoren-9-yl]phenyl]anthracene?
The InChIKey is VPTDGTYSWOLBAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H38/c1-2-16-43-38-44(29-28-39(43)14-1)58-53-23-7-5-21-51(53)57(52-22-6-8-24-54(52)58)42-32-36-46(37-33-42)59(55-26-11-9-19-49(55)50-20-10-12-27-56(50)59)45-34-30-41(31-35-45)48-25-13-17-40-15-3-4-18-47(40)48/h1-38H.
What are the key properties of 9-naphthalen-2-yl-10-[4-[9-(4-naphthalen-1-ylphenyl)fluoren-9-yl]phenyl]anthracene?
9-naphthalen-2-yl-10-[4-[9-(4-naphthalen-1-ylphenyl)fluoren-9-yl]phenyl]anthracene has a molecular weight of 746.95 g/mol, XLogP of 15.66, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-naphthalen-2-yl-10-[4-[9-(4-naphthalen-1-ylphenyl)fluoren-9-yl]phenyl]anthracene is sourced from PubChem (CID 123292733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).