2-phenyl-10-(10-phenylanthracen-9-yl)phenanthrene

C40H26 — CID 123229235

IUPAC2-phenyl-10-(10-phenylanthracen-9-yl)phenanthrene
SMILESc1ccc(-c2ccc3c(c2)c(-c2c4ccccc4c(-c4ccccc4)c4ccccc24)cc2ccccc23)cc1
InChIInChI=1S/C40H26/c1-3-13-27(14-4-1)29-23-24-32-31-18-8-7-17-30(31)26-38(37(32)25-29)40-35-21-11-9-19-33(35)39(28-15-5-2-6-16-28)34-20-10-12-22-36(34)40/h1-26H
InChIKeyHLGADWSYUBCZDZ-UHFFFAOYSA-N
MW506.65 g/mol
LogP11.30
Rot. Bonds3

About 2-phenyl-10-(10-phenylanthracen-9-yl)phenanthrene

2-phenyl-10-(10-phenylanthracen-9-yl)phenanthrene (PubChem CID 123229235) has the molecular formula C40H26 and a molecular weight of 506.65 g/mol. Its IUPAC name is 2-phenyl-10-(10-phenylanthracen-9-yl)phenanthrene.

Molecular Properties

Compound Name2-phenyl-10-(10-phenylanthracen-9-yl)phenanthrene
PubChem CID123229235
Molecular FormulaC40H26
Molecular Weight506.65 g/mol
Exact Mass506.20
IUPAC Name2-phenyl-10-(10-phenylanthracen-9-yl)phenanthrene
SMILESc1ccc(-c2ccc3c(c2)c(-c2c4ccccc4c(-c4ccccc4)c4ccccc24)cc2ccccc23)cc1
InChIInChI=1S/C40H26/c1-3-13-27(14-4-1)29-23-24-32-31-18-8-7-17-30(31)26-38(37(32)25-29)40-35-21-11-9-19-33(35)39(28-15-5-2-6-16-28)34-20-10-12-22-36(34)40/h1-26H
InChIKeyHLGADWSYUBCZDZ-UHFFFAOYSA-N
XLogP11.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500506.65
LogP ≤ 511.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

9-phenanthren-9-yl-2-phenyl-10-(4-phenylphenyl)anthracene
CID 58323135
9,10-bis(4-phenanthren-9-ylphenyl)-2-phenylanthracene
CID 58323001
9-phenanthren-9-yl-10-phenylanthracene
CID 59592440
10-phenanthren-9-yl-9-(3-phenanthren-9-ylphenyl)-2-phenylanthracene
CID 58322788
2,9-bis(4-methylphenyl)-10-phenanthren-9-ylanthracene
CID 156622206
2-phenanthren-9-yl-10-(3-phenylphenyl)-9-(4-phenylphenyl)anthracene
CID 59002225
9-naphthalen-2-yl-10-(10-naphthalen-2-ylanthracen-9-yl)anthracene;9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene;9-phenanthren-9-yl-10-(10-phenanthren-9-ylanthracen-9-yl)anthracene;9-phenyl-10-[10-(4-phenylphenyl)anthracen-9-yl]anthracene
CID 159797606
9-phenanthren-9-yl-2-phenyl-10-[2-(4-phenylphenyl)phenyl]anthracene
CID 59793185
10-phenanthren-9-yl-9-(2-phenanthren-9-ylphenyl)-2-phenylanthracene
CID 58322811
9-phenanthren-9-yl-10-(4-phenanthren-9-ylphenyl)anthracene
CID 59793080
2-naphthalen-1-yl-9-(2-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-9-(3-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(3-phenylphenyl)anthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(4-phenylphenyl)anthracene
CID 161364950
2-(10-phenanthren-9-yl-2-phenylanthracen-9-yl)dibenzofuran
CID 58323704

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-10-(10-phenylanthracen-9-yl)phenanthrene?
The IUPAC name of 2-phenyl-10-(10-phenylanthracen-9-yl)phenanthrene (CID 123229235) is 2-phenyl-10-(10-phenylanthracen-9-yl)phenanthrene.
What is the SMILES notation for 2-phenyl-10-(10-phenylanthracen-9-yl)phenanthrene?
The canonical SMILES for 2-phenyl-10-(10-phenylanthracen-9-yl)phenanthrene is c1ccc(-c2ccc3c(c2)c(-c2c4ccccc4c(-c4ccccc4)c4ccccc24)cc2ccccc23)cc1.
What is the InChIKey of 2-phenyl-10-(10-phenylanthracen-9-yl)phenanthrene?
The InChIKey is HLGADWSYUBCZDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H26/c1-3-13-27(14-4-1)29-23-24-32-31-18-8-7-17-30(31)26-38(37(32)25-29)40-35-21-11-9-19-33(35)39(28-15-5-2-6-16-28)34-20-10-12-22-36(34)40/h1-26H.
What are the key properties of 2-phenyl-10-(10-phenylanthracen-9-yl)phenanthrene?
2-phenyl-10-(10-phenylanthracen-9-yl)phenanthrene has a molecular weight of 506.65 g/mol, XLogP of 11.30, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-10-(10-phenylanthracen-9-yl)phenanthrene is sourced from PubChem (CID 123229235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).