9-phenyl-10-[7-phenyl-8-[4-(2-phenylphenyl)phenyl]naphthalen-2-yl]anthracene

C54H36 — CID 144837407

IUPAC9-phenyl-10-[7-phenyl-8-[4-(2-phenylphenyl)phenyl]naphthalen-2-yl]anthracene
SMILESc1ccc(-c2ccccc2-c2ccc(-c3c(-c4ccccc4)ccc4ccc(-c5c6ccccc6c(-c6ccccc6)c6ccccc56)cc34)cc2)cc1
InChIInChI=1S/C54H36/c1-4-16-37(17-5-1)44-22-10-11-23-45(44)39-28-31-42(32-29-39)52-46(38-18-6-2-7-19-38)35-34-40-30-33-43(36-51(40)52)54-49-26-14-12-24-47(49)53(41-20-8-3-9-21-41)48-25-13-15-27-50(48)54/h1-36H
InChIKeyUGMDNAYHNLXECC-UHFFFAOYSA-N
MW684.88 g/mol
LogP15.15
Rot. Bonds6

About 9-phenyl-10-[7-phenyl-8-[4-(2-phenylphenyl)phenyl]naphthalen-2-yl]anthracene

9-phenyl-10-[7-phenyl-8-[4-(2-phenylphenyl)phenyl]naphthalen-2-yl]anthracene (PubChem CID 144837407) has the molecular formula C54H36 and a molecular weight of 684.88 g/mol. Its IUPAC name is 9-phenyl-10-[7-phenyl-8-[4-(2-phenylphenyl)phenyl]naphthalen-2-yl]anthracene.

Molecular Properties

Compound Name9-phenyl-10-[7-phenyl-8-[4-(2-phenylphenyl)phenyl]naphthalen-2-yl]anthracene
PubChem CID144837407
Molecular FormulaC54H36
Molecular Weight684.88 g/mol
Exact Mass684.28
IUPAC Name9-phenyl-10-[7-phenyl-8-[4-(2-phenylphenyl)phenyl]naphthalen-2-yl]anthracene
SMILESc1ccc(-c2ccccc2-c2ccc(-c3c(-c4ccccc4)ccc4ccc(-c5c6ccccc6c(-c6ccccc6)c6ccccc56)cc34)cc2)cc1
InChIInChI=1S/C54H36/c1-4-16-37(17-5-1)44-22-10-11-23-45(44)39-28-31-42(32-29-39)52-46(38-18-6-2-7-19-38)35-34-40-30-33-43(36-51(40)52)54-49-26-14-12-24-47(49)53(41-20-8-3-9-21-41)48-25-13-15-27-50(48)54/h1-36H
InChIKeyUGMDNAYHNLXECC-UHFFFAOYSA-N
XLogP15.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500684.88
LogP ≤ 515.15
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-[8-(3-naphthalen-1-ylphenyl)-7-phenylnaphthalen-2-yl]-10-phenylanthracene
CID 144837284
9-(3-naphthalen-1-ylphenyl)-10-[4-(1-phenylnaphthalen-2-yl)phenyl]anthracene
CID 59413134
3-phenyl-6-[10-(2-phenylphenyl)anthracen-9-yl]phenanthrene
CID 177264858
9-[8-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]-10-phenylanthracene
CID 144837308
9-[5,8-bis(2-phenylphenyl)naphthalen-2-yl]-10-phenylanthracene
CID 144837329
9-phenanthren-3-yl-10-[4-(2-phenylphenyl)naphthalen-1-yl]anthracene
CID 58194536
9-[7-naphthalen-2-yl-8-[3-(4-phenylphenyl)phenyl]naphthalen-2-yl]-10-phenylanthracene
CID 144837172
1,2-diphenylbenzene;bis(1,2-diphenylnaphthalene);2,3-diphenylnaphthalene;1,2-diphenylphenanthrene;9,10-diphenylphenanthrene
CID 157199364
9-[3-(1-naphthalen-2-ylnaphthalen-2-yl)phenyl]-10-[4-(2-phenylnaphthalen-1-yl)phenyl]anthracene
CID 59413105
9,10-bis[3-(1-phenylnaphthalen-2-yl)phenyl]anthracene
CID 59413167
9-(3,4-diphenylphenyl)-10-(4-phenylphenyl)anthracene
CID 164706372
9-[4-(2,6-diphenylphenyl)phenyl]-10-naphthalen-2-ylanthracene
CID 58965768

Frequently Asked Questions

What is the IUPAC name of 9-phenyl-10-[7-phenyl-8-[4-(2-phenylphenyl)phenyl]naphthalen-2-yl]anthracene?
The IUPAC name of 9-phenyl-10-[7-phenyl-8-[4-(2-phenylphenyl)phenyl]naphthalen-2-yl]anthracene (CID 144837407) is 9-phenyl-10-[7-phenyl-8-[4-(2-phenylphenyl)phenyl]naphthalen-2-yl]anthracene.
What is the SMILES notation for 9-phenyl-10-[7-phenyl-8-[4-(2-phenylphenyl)phenyl]naphthalen-2-yl]anthracene?
The canonical SMILES for 9-phenyl-10-[7-phenyl-8-[4-(2-phenylphenyl)phenyl]naphthalen-2-yl]anthracene is c1ccc(-c2ccccc2-c2ccc(-c3c(-c4ccccc4)ccc4ccc(-c5c6ccccc6c(-c6ccccc6)c6ccccc56)cc34)cc2)cc1.
What is the InChIKey of 9-phenyl-10-[7-phenyl-8-[4-(2-phenylphenyl)phenyl]naphthalen-2-yl]anthracene?
The InChIKey is UGMDNAYHNLXECC-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H36/c1-4-16-37(17-5-1)44-22-10-11-23-45(44)39-28-31-42(32-29-39)52-46(38-18-6-2-7-19-38)35-34-40-30-33-43(36-51(40)52)54-49-26-14-12-24-47(49)53(41-20-8-3-9-21-41)48-25-13-15-27-50(48)54/h1-36H.
What are the key properties of 9-phenyl-10-[7-phenyl-8-[4-(2-phenylphenyl)phenyl]naphthalen-2-yl]anthracene?
9-phenyl-10-[7-phenyl-8-[4-(2-phenylphenyl)phenyl]naphthalen-2-yl]anthracene has a molecular weight of 684.88 g/mol, XLogP of 15.15, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-10-[7-phenyl-8-[4-(2-phenylphenyl)phenyl]naphthalen-2-yl]anthracene is sourced from PubChem (CID 144837407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).