9-(3,5-dimethylphenyl)-10-phenylanthracene

C28H22 — CID 170561654

IUPAC9-(3,5-dimethylphenyl)-10-phenylanthracene
SMILESCc1cc(C)cc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)c1
InChIInChI=1S/C28H22/c1-19-16-20(2)18-22(17-19)28-25-14-8-6-12-23(25)27(21-10-4-3-5-11-21)24-13-7-9-15-26(24)28/h3-18H,1-2H3
InChIKeyQMZZDGIGFYERDD-UHFFFAOYSA-N
MW358.48 g/mol
LogP7.94
Rot. Bonds2

About 9-(3,5-dimethylphenyl)-10-phenylanthracene

9-(3,5-dimethylphenyl)-10-phenylanthracene (PubChem CID 170561654) has the molecular formula C28H22 and a molecular weight of 358.48 g/mol. Its IUPAC name is 9-(3,5-dimethylphenyl)-10-phenylanthracene.

Molecular Properties

Compound Name9-(3,5-dimethylphenyl)-10-phenylanthracene
PubChem CID170561654
Molecular FormulaC28H22
Molecular Weight358.48 g/mol
Exact Mass358.17
IUPAC Name9-(3,5-dimethylphenyl)-10-phenylanthracene
SMILESCc1cc(C)cc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)c1
InChIInChI=1S/C28H22/c1-19-16-20(2)18-22(17-19)28-25-14-8-6-12-23(25)27(21-10-4-3-5-11-21)24-13-7-9-15-26(24)28/h3-18H,1-2H3
InChIKeyQMZZDGIGFYERDD-UHFFFAOYSA-N
XLogP7.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.48
LogP ≤ 57.94
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-[3-methyl-5-[10-(4-methylphenyl)anthracen-9-yl]phenyl]-10-(4-methylphenyl)anthracene
CID 58722434
9-(4-methylphenyl)-10-phenylanthracene
CID 631292
9-[4-[10-(3,5-dimethylphenyl)anthracen-9-yl]phenyl]carbazole;9-[4-[10-(4-methylphenyl)anthracen-9-yl]phenyl]carbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole
CID 162257704
9,10-bis(4-methylphenyl)anthracene;methane
CID 162058146
9-methyl-10-(4-phenylphenyl)anthracene
CID 58820618
9-(4-methylphenyl)-10-(4-phenylnaphthalen-1-yl)anthracene
CID 123303809
9-(3-methyl-4-phenylnaphthalen-1-yl)-10-phenylanthracene
CID 140762183
9-(4-methylphenyl)-10-(4-tritiophenyl)anthracene
CID 58151376
9-methyl-10-(4-methylphenyl)anthracene
CID 159479529
9,10-diphenylanthracene;ethane;9-methyl-10-phenylanthracene
CID 143856164
methane;9-(4-phenylphenyl)-10-[10-(4-phenylphenyl)anthracen-9-yl]anthracene
CID 143224896
1,3-dimethyl-5-phenylbenzene;methane
CID 143325792

Frequently Asked Questions

What is the IUPAC name of 9-(3,5-dimethylphenyl)-10-phenylanthracene?
The IUPAC name of 9-(3,5-dimethylphenyl)-10-phenylanthracene (CID 170561654) is 9-(3,5-dimethylphenyl)-10-phenylanthracene.
What is the SMILES notation for 9-(3,5-dimethylphenyl)-10-phenylanthracene?
The canonical SMILES for 9-(3,5-dimethylphenyl)-10-phenylanthracene is Cc1cc(C)cc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)c1.
What is the InChIKey of 9-(3,5-dimethylphenyl)-10-phenylanthracene?
The InChIKey is QMZZDGIGFYERDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H22/c1-19-16-20(2)18-22(17-19)28-25-14-8-6-12-23(25)27(21-10-4-3-5-11-21)24-13-7-9-15-26(24)28/h3-18H,1-2H3.
What are the key properties of 9-(3,5-dimethylphenyl)-10-phenylanthracene?
9-(3,5-dimethylphenyl)-10-phenylanthracene has a molecular weight of 358.48 g/mol, XLogP of 7.94, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(3,5-dimethylphenyl)-10-phenylanthracene is sourced from PubChem (CID 170561654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).