1-methyl-3-[3-methyl-5-(4-methylphenyl)phenyl]-5-(4-methylphenyl)benzene

C28H26 — CID 58892368

IUPAC1-methyl-3-[3-methyl-5-(4-methylphenyl)phenyl]-5-(4-methylphenyl)benzene
SMILESCc1ccc(-c2cc(C)cc(-c3cc(C)cc(-c4ccc(C)cc4)c3)c2)cc1
InChIInChI=1S/C28H26/c1-19-5-9-23(10-6-19)25-13-21(3)15-27(17-25)28-16-22(4)14-26(18-28)24-11-7-20(2)8-12-24/h5-18H,1-4H3
InChIKeyHEKZUDSFQOBXOI-UHFFFAOYSA-N
MW362.52 g/mol
LogP7.92
Rot. Bonds3

About 1-methyl-3-[3-methyl-5-(4-methylphenyl)phenyl]-5-(4-methylphenyl)benzene

1-methyl-3-[3-methyl-5-(4-methylphenyl)phenyl]-5-(4-methylphenyl)benzene (PubChem CID 58892368) has the molecular formula C28H26 and a molecular weight of 362.52 g/mol. Its IUPAC name is 1-methyl-3-[3-methyl-5-(4-methylphenyl)phenyl]-5-(4-methylphenyl)benzene.

Molecular Properties

Compound Name1-methyl-3-[3-methyl-5-(4-methylphenyl)phenyl]-5-(4-methylphenyl)benzene
PubChem CID58892368
Molecular FormulaC28H26
Molecular Weight362.52 g/mol
Exact Mass362.20
IUPAC Name1-methyl-3-[3-methyl-5-(4-methylphenyl)phenyl]-5-(4-methylphenyl)benzene
SMILESCc1ccc(-c2cc(C)cc(-c3cc(C)cc(-c4ccc(C)cc4)c3)c2)cc1
InChIInChI=1S/C28H26/c1-19-5-9-23(10-6-19)25-13-21(3)15-27(17-25)28-16-22(4)14-26(18-28)24-11-7-20(2)8-12-24/h5-18H,1-4H3
InChIKeyHEKZUDSFQOBXOI-UHFFFAOYSA-N
XLogP7.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.52
LogP ≤ 57.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-[4-[3,5-bis(4-methylphenyl)phenyl]phenyl]-3,5-dimethylbenzene
CID 58892382
ethane;1,3,5-tris(4-methylphenyl)benzene
CID 91508266
1-methyl-3-[4-[3-(4-methylphenyl)-5-phenylphenyl]phenyl]-5-phenylbenzene
CID 58892417
1-methyl-3,5-bis[3-(4-methylphenyl)phenyl]benzene
CID 59552733
1-(4-methylphenyl)-3,5-bis(4-phenylphenyl)benzene
CID 142935427
1-(3,5-diphenylphenyl)-3-methyl-5-phenylbenzene
CID 123422549
1,3-dimethyl-5-(4-methylphenyl)benzene;ethanol
CID 123650314
ethane;3-methylbicyclo[3.1.0]hexa-1(6),2,4-triene;toluene
CID 142960014
[4-[3-methyl-5-[4-(phosphanylmethyl)phenyl]phenyl]phenyl]methylphosphane
CID 135225292
bis(1,3-dimethyl-5-phenylbenzene);tris(1,3,5-trimethylbenzene);1,3-xylene;bis(1,4-xylene)
CID 159852907
1-methyl-3-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene
CID 58892418
3-[3-methyl-5-(4-methylphenyl)phenyl]pyridine
CID 130388822

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-[3-methyl-5-(4-methylphenyl)phenyl]-5-(4-methylphenyl)benzene?
The IUPAC name of 1-methyl-3-[3-methyl-5-(4-methylphenyl)phenyl]-5-(4-methylphenyl)benzene (CID 58892368) is 1-methyl-3-[3-methyl-5-(4-methylphenyl)phenyl]-5-(4-methylphenyl)benzene.
What is the SMILES notation for 1-methyl-3-[3-methyl-5-(4-methylphenyl)phenyl]-5-(4-methylphenyl)benzene?
The canonical SMILES for 1-methyl-3-[3-methyl-5-(4-methylphenyl)phenyl]-5-(4-methylphenyl)benzene is Cc1ccc(-c2cc(C)cc(-c3cc(C)cc(-c4ccc(C)cc4)c3)c2)cc1.
What is the InChIKey of 1-methyl-3-[3-methyl-5-(4-methylphenyl)phenyl]-5-(4-methylphenyl)benzene?
The InChIKey is HEKZUDSFQOBXOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H26/c1-19-5-9-23(10-6-19)25-13-21(3)15-27(17-25)28-16-22(4)14-26(18-28)24-11-7-20(2)8-12-24/h5-18H,1-4H3.
What are the key properties of 1-methyl-3-[3-methyl-5-(4-methylphenyl)phenyl]-5-(4-methylphenyl)benzene?
1-methyl-3-[3-methyl-5-(4-methylphenyl)phenyl]-5-(4-methylphenyl)benzene has a molecular weight of 362.52 g/mol, XLogP of 7.92, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-[3-methyl-5-(4-methylphenyl)phenyl]-5-(4-methylphenyl)benzene is sourced from PubChem (CID 58892368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).