9-naphthalen-2-yl-1-phenyl-10-(4-phenylphenyl)anthracene

C42H28 — CID 58323204

IUPAC9-naphthalen-2-yl-1-phenyl-10-(4-phenylphenyl)anthracene
SMILESc1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4c(-c5ccccc5)cccc34)cc2)cc1
InChIInChI=1S/C42H28/c1-3-12-29(13-4-1)31-22-25-33(26-23-31)40-37-18-9-10-19-38(37)41(35-27-24-30-14-7-8-17-34(30)28-35)42-36(20-11-21-39(40)42)32-15-5-2-6-16-32/h1-28H
InChIKeyDHPLTWMKJFWNTC-UHFFFAOYSA-N
MW532.69 g/mol
LogP11.81
Rot. Bonds4

About 9-naphthalen-2-yl-1-phenyl-10-(4-phenylphenyl)anthracene

9-naphthalen-2-yl-1-phenyl-10-(4-phenylphenyl)anthracene (PubChem CID 58323204) has the molecular formula C42H28 and a molecular weight of 532.69 g/mol. Its IUPAC name is 9-naphthalen-2-yl-1-phenyl-10-(4-phenylphenyl)anthracene.

Molecular Properties

Compound Name9-naphthalen-2-yl-1-phenyl-10-(4-phenylphenyl)anthracene
PubChem CID58323204
Molecular FormulaC42H28
Molecular Weight532.69 g/mol
Exact Mass532.22
IUPAC Name9-naphthalen-2-yl-1-phenyl-10-(4-phenylphenyl)anthracene
SMILESc1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4c(-c5ccccc5)cccc34)cc2)cc1
InChIInChI=1S/C42H28/c1-3-12-29(13-4-1)31-22-25-33(26-23-31)40-37-18-9-10-19-38(37)41(35-27-24-30-14-7-8-17-34(30)28-35)42-36(20-11-21-39(40)42)32-15-5-2-6-16-32/h1-28H
InChIKeyDHPLTWMKJFWNTC-UHFFFAOYSA-N
XLogP11.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500532.69
LogP ≤ 511.81
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-[4-(2,6-diphenylphenyl)phenyl]-10-naphthalen-2-ylanthracene
CID 58965768
10-naphthalen-1-yl-9-(3-naphthalen-2-ylphenyl)-1-(4-phenylphenyl)anthracene
CID 58323114
9-[6-(4,5-diphenylnaphthalen-1-yl)naphthalen-2-yl]-10-naphthalen-2-ylanthracene
CID 123216582
9-(4-naphthalen-2-ylphenyl)-10-[7-(2-phenylphenyl)naphthalen-2-yl]anthracene
CID 123334632
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-(4-naphthalen-2-ylphenyl)-10-[3-(3-phenylphenyl)phenyl]anthracene
CID 144568832
9,10-bis(3-naphthalen-1-ylphenyl)anthracene;9,10-bis(3-naphthalen-2-ylphenyl)anthracene;9,10-bis(4-naphthalen-1-ylphenyl)anthracene;9,10-bis(4-naphthalen-2-ylphenyl)anthracene;9-(3-naphthalen-1-ylphenyl)-10-(4-phenylphenyl)anthracene;9-(3-naphthalen-2-ylphenyl)-10-(4-phenylphenyl)anthracene;9-(4-naphthalen-1-ylphenyl)-10-(3-phenylphenyl)anthracene
CID 161131758
9-naphthalen-2-yl-10-(10-phenylanthracen-9-yl)anthracene;9-naphthalen-2-yl-10-[10-(2-phenylphenyl)anthracen-9-yl]anthracene;9-naphthalen-2-yl-10-[10-(3-phenylphenyl)anthracen-9-yl]anthracene;9-naphthalen-2-yl-10-[10-(4-phenylphenyl)anthracen-9-yl]anthracene
CID 161288409
9-naphthalen-2-yl-10-[10-(2-phenylphenyl)anthracen-9-yl]anthracene;9-naphthalen-2-yl-10-[10-(3-phenylphenyl)anthracen-9-yl]anthracene;9-naphthalen-2-yl-10-[10-(4-phenylphenyl)anthracen-9-yl]anthracene;9-phenyl-10-[4-(10-phenylanthracen-9-yl)phenyl]anthracene
CID 159178358
9-naphthalen-2-yl-10-[4-(10-phenylanthracen-9-yl)phenyl]anthracene
CID 58876197
10-naphthalen-1-yl-9-(2-naphthalen-1-ylphenyl)-1-(4-phenylphenyl)anthracene;10-naphthalen-1-yl-9-(3-naphthalen-1-ylphenyl)-1-(4-phenylphenyl)anthracene;10-naphthalen-1-yl-9-(3-naphthalen-2-ylphenyl)-1-(4-phenylphenyl)anthracene;10-naphthalen-1-yl-9-(4-naphthalen-2-ylphenyl)-1-(4-phenylphenyl)anthracene
CID 161483242

Frequently Asked Questions

What is the IUPAC name of 9-naphthalen-2-yl-1-phenyl-10-(4-phenylphenyl)anthracene?
The IUPAC name of 9-naphthalen-2-yl-1-phenyl-10-(4-phenylphenyl)anthracene (CID 58323204) is 9-naphthalen-2-yl-1-phenyl-10-(4-phenylphenyl)anthracene.
What is the SMILES notation for 9-naphthalen-2-yl-1-phenyl-10-(4-phenylphenyl)anthracene?
The canonical SMILES for 9-naphthalen-2-yl-1-phenyl-10-(4-phenylphenyl)anthracene is c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4c(-c5ccccc5)cccc34)cc2)cc1.
What is the InChIKey of 9-naphthalen-2-yl-1-phenyl-10-(4-phenylphenyl)anthracene?
The InChIKey is DHPLTWMKJFWNTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H28/c1-3-12-29(13-4-1)31-22-25-33(26-23-31)40-37-18-9-10-19-38(37)41(35-27-24-30-14-7-8-17-34(30)28-35)42-36(20-11-21-39(40)42)32-15-5-2-6-16-32/h1-28H.
What are the key properties of 9-naphthalen-2-yl-1-phenyl-10-(4-phenylphenyl)anthracene?
9-naphthalen-2-yl-1-phenyl-10-(4-phenylphenyl)anthracene has a molecular weight of 532.69 g/mol, XLogP of 11.81, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-naphthalen-2-yl-1-phenyl-10-(4-phenylphenyl)anthracene is sourced from PubChem (CID 58323204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).