4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene

C27H24 — CID 58892355

IUPAC4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene
SMILESCc1cccc(-c2ccccc2-c2ccc(C)cc2-c2cccc(C)c2)c1
InChIInChI=1S/C27H24/c1-19-8-6-10-22(16-19)24-12-4-5-13-25(24)26-15-14-21(3)18-27(26)23-11-7-9-20(2)17-23/h4-18H,1-3H3
InChIKeyYGZRTIXSPJPPDP-UHFFFAOYSA-N
MW348.49 g/mol
LogP7.61
Rot. Bonds3

About 4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene

4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene (PubChem CID 58892355) has the molecular formula C27H24 and a molecular weight of 348.49 g/mol. Its IUPAC name is 4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene.

Molecular Properties

Compound Name4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene
PubChem CID58892355
Molecular FormulaC27H24
Molecular Weight348.49 g/mol
Exact Mass348.19
IUPAC Name4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene
SMILESCc1cccc(-c2ccccc2-c2ccc(C)cc2-c2cccc(C)c2)c1
InChIInChI=1S/C27H24/c1-19-8-6-10-22(16-19)24-12-4-5-13-25(24)26-15-14-21(3)18-27(26)23-11-7-9-20(2)17-23/h4-18H,1-3H3
InChIKeyYGZRTIXSPJPPDP-UHFFFAOYSA-N
XLogP7.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.49
LogP ≤ 57.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene?
The IUPAC name of 4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene (CID 58892355) is 4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene.
What is the SMILES notation for 4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene?
The canonical SMILES for 4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene is Cc1cccc(-c2ccccc2-c2ccc(C)cc2-c2cccc(C)c2)c1.
What is the InChIKey of 4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene?
The InChIKey is YGZRTIXSPJPPDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H24/c1-19-8-6-10-22(16-19)24-12-4-5-13-25(24)26-15-14-21(3)18-27(26)23-11-7-9-20(2)17-23/h4-18H,1-3H3.
What are the key properties of 4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene?
4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene has a molecular weight of 348.49 g/mol, XLogP of 7.61, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene is sourced from PubChem (CID 58892355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).